Variant

Genome Chromosome Position VCF ID Ref Alt mRNA Change mRNA Info
GRCh37 chr1 115256536 . C A CCDS877.1:NM_002524.4:c.175Gct>Tct_NP_002515.1:p.59A>S Homo sapiens neuroblastoma RAS viral oncogene homolog (NRAS), mRNA.
pdb_id
label_asym_id
label_seq_id
label_comp_id
auth_asym_id
auth_seq_id
alphafold_id
label_asym_id
label_seq_id
label_comp_id
auth_asym_id
auth_seq_id

PDB

Entity Residue Monomer BioUnit Ligand View
PDB Entity Uniprot Identity Evalue ExpMethod Date Name Label Auth ASA rASA SS φ ψ ASA rASA ΔASA Interaction Name Distance Atom(p) Atom(l)
3con 1 P01111 100.0 2e-127 X-RAY
2008-04-08 ALA A:77 A:59 25.0 0.217 -135.8 148.0 25.0 0.217 0.0 MG
GDP
UNX
HOH
5.312
6.664
5.039
3.019
CB
CA
N
O
MG
O1B
UNK
O
6zio 1 P01111 99.42 3e-126 X-RAY
2020-08-19 ALA A:60 A:59 16.0 0.139 -114.6 -10.4 16.0 0.139 0.0 MG
GDP
HOH
5.212
6.309
2.983
CA
O
O
MG
O3B
O
ALA B:60 B:59 17.0 0.148 -117.1 -11.6 17.0 0.148 0.0 MG
GDP
HOH
5.134
6.300
2.796
CA
O
O
MG
O2B
O
6zir 1 P01111 99.42 3e-126 X-RAY
2020-08-19 ALA A:60 A:59 27.0 0.235 -122.9 0.8 27.0 0.235 0.0 MG
GDP
EZZ
HOH
5.290
6.468
7.543
2.997
CB
CA
N
O
MG
O1B
O22
O
6ziz 1 P01111 98.84 1e-125 X-RAY
2020-08-19 ALA A:60 A:59 3.0 0.026 -81.9 128.4 3.0 0.026 0.0 GTP
MG
EZZ
HOH
3.560
5.058
7.153
2.017
HA
HA
H
H
O1G
MG
H20
O
ALA B:60 B:59 4.0 0.035 -81.1 127.9 NA NA NA
5uhv 1 P01111 100.0 2e-122 X-RAY
2017-06-28 ALA A:59 A:59 2.0 0.017 -88.8 142.8 2.0 0.017 0.0 GNP
MG
HOH
3.973
5.779
2.894
C
CA
O
O3G
MG
O
6e6h 1 P01111 99.4 2e-121 X-RAY
2019-07-31 ALA A:59 NA:NA DO NA DO DO DO NA NA NA
6mqn 1 P01116 91.12 1e-114 X-RAY
2019-07-31 ALA A:59 A:59 39.0 0.339 G -48.7 -23.4 39.0 0.339 0.0 GDP
HOH
7.681
2.937
H
O
O1B
O
ALA B:59 NA:NA DO NA DO DO DO NA NA NA
ALA C:59 NA:NA DO NA DO DO DO NA NA NA
6wgh 1 P01111 94.44 4e-114 X-RAY
2020-05-20 ALA A:70 NA:NA DO NA DO DO DO NA NA NA
ALA B:70 NA:NA DO NA DO DO DO NA NA NA
5xco 1 P01116 91.12 8e-114 X-RAY
2017-05-24 ALA A:61 A:59 4.0 0.035 -168.2 168.8 4.0 0.035 0.0 GDP
HOH
5.599
3.359
CB
CA
O2B
O
6ob3 1 P01116 91.12 1e-113 X-RAY
2019-10-16 ALA A:60 A:59 6.0 0.052 -87.5 127.0 6.0 0.052 0.0 GNP
MG
HOH
3.985
5.935
2.771
C
CA
O
O3G
MG
O
ALA C:60 C:59 7.0 0.061 -86.9 130.8 NA NA NA
6xgv 1 P01116 91.12 1e-113 X-RAY
2021-01-13 ALA A:60 A:59 5.0 0.043 -87.3 139.2 5.0 0.043 0.0 GNP
MG
HOH
4.176
6.199
2.725
CA
CA
N
O1G
MG
O
7kfz 1 P01116 91.12 1e-113 EM
2021-03-31 ALA A:60 A:59 43.0 0.374 T -60.7 144.9 3.0 0.026 0.348 B:Q07889:0.348
ALA C:60 C:59 2.0 0.017 -102.0 144.0 1.0 0.009 0.008 B:Q07889:0.009
GNP
MG
4.145
5.604
C
CA
O2G
MG
6gj6 1 P01116 91.12 1e-113 X-RAY
2019-07-31 ALA A:60 A:59 39.0 0.339 -84.3 141.0 39.0 0.339 0.0 MG
GCP
EZZ
HOH
6.114
4.187
8.439
2.928
CA
C
N
O
MG
O3G
O22
O
6gj7 1 P01116 91.12 1e-113 X-RAY
2019-07-31 ALA A:60 A:59 7.0 0.061 -85.2 132.8 7.0 0.061 0.0 MG
GCP
F0B
HOH
6.049
4.057
8.839
2.735
CA
C
N
O
MG
O2G
O1
O
6quv 1 P01116 91.12 1e-113 X-RAY
2019-07-31 ALA A:60 A:59 7.0 0.061 -81.7 132.7 7.0 0.061 0.0 GCP
MG
HOH
4.126
6.013
2.692
C
CA
O
O2G
MG
O
ALA B:60 B:59 6.0 0.052 -79.6 132.6 6.0 0.052 0.0 GCP
MG
HOH
4.030
5.969
2.632
C
CA
O
O2G
MG
O
6quw 1 P01116 91.12 1e-113 X-RAY
2019-07-31 ALA A:60 A:59 8.0 0.07 -81.6 134.2 8.0 0.07 0.0 GCP
MG
HOH
3.997
6.006
2.688
C
CA
O
HOG2
MG
O
ALA B:60 B:59 7.0 0.061 -80.5 134.5 7.0 0.061 0.0 GCP
MG
HOH
3.915
5.923
2.665
C
CA
O
HOG2
MG
O
6qux 1 P01116 91.12 1e-113 X-RAY
2019-07-31 ALA A:60 A:59 7.0 0.061 -85.4 130.4 7.0 0.061 0.0 GCP
MG
HOH
3.825
5.081
2.152
HA
HA
H
O1G
MG
O
ALA B:60 B:59 7.0 0.061 -85.1 131.0 7.0 0.061 0.0 EDO
GCP
MG
HOH
8.299
3.742
4.989
2.193
H
HA
HA
H
O1
O1G
MG
O
6zli 1 P01116 91.12 1e-113 X-RAY
2020-08-19 ALA A:60 A:59 8.0 0.07 -82.2 134.1 8.0 0.07 0.0 GCP
MG
HOH
4.124
5.949
2.603
C
CA
O
O2G
MG
O
ALA B:60 B:59 7.0 0.061 -80.5 132.3 NA NA NA
7aca 1 P01116 91.12 1e-113 X-RAY
2020-11-18 ALA A:60 A:59 21.0 0.183 -80.2 146.9 21.0 0.183 0.0 MG
GCP
R6W
HOH
5.915
4.106
8.862
2.768
CA
C
N
O
MG
O2G
O50
O
ALA B:60 B:59 8.0 0.07 -82.6 141.3 NA NA NA
ALA C:60 C:59 21.0 0.183 -81.0 146.1 NA NA NA
ALA D:60 D:59 16.0 0.139 -81.5 149.7 16.0 0.139 0.0 MG
GCP
HOH
5.901
4.216
2.741
CA
C
O
MG
O1G
O
7acf 1 P01116 91.12 1e-113 X-RAY
2020-11-18 ALA A:60 A:59 4.0 0.035 -81.7 136.3 4.0 0.035 0.0 MG
GCP
R6W
HOH
5.899
3.978
9.003
2.961
CA
C
N
O
MG
O1G
O22
O
ALA B:60 B:59 2.0 0.017 -82.4 138.5 2.0 0.017 0.0 MG
GCP
HOH
5.883
4.019
2.811
CA
C
O
MG
O1G
O
ALA C:60 C:59 8.0 0.07 -81.9 146.0 NA NA NA
ALA D:60 D:59 11.0 0.096 -81.5 148.0 NA NA NA
7ach 1 P01116 91.12 1e-113 X-RAY
2020-11-18 ALA A:60 A:59 9.0 0.078 -80.4 132.2 9.0 0.078 0.0 R6W
GCP
MG
HOH
8.682
4.029
6.006
2.812
N
C
CA
O
O50
O3G
MG
O
ALA B:60 B:59 7.0 0.061 -79.6 132.4 7.0 0.061 0.0 R6W
GCP
MG
HOH
8.651
4.043
5.937
2.661
N
C
CA
O
O22
O3G
MG
O
7acq 1 P01116 91.12 1e-113 X-RAY
2020-11-18 ALA A:60 A:59 9.0 0.078 -107.5 -76.6 9.0 0.078 0.0 GDP
MG
R6W
HOH
6.228
5.166
8.895
2.600
O
CA
N
O
O3B
MG
O22
O
ALA B:60 B:59 12.0 0.104 -109.5 -78.7 12.0 0.104 0.0 R6W
GDP
MG
HOH
8.892
6.458
5.243
2.767
N
O
CA
O
O50
O1B
MG
O
ALA C:60 C:59 59.0 0.513 -65.0 360.0 59.0 0.513 0.0 R6W
GDP
MG
HOH
8.686
6.123
5.463
2.260
N
C
CA
O
O50
O1B
MG
O
7ew9 1 P01116 91.12 1e-113 X-RAY
2021-12-29 ALA A:60 A:59 12.0 0.104 -168.1 -162.3 12.0 0.104 0.0 MG
05C
GDP
HOH
4.480
3.830
6.186
3.270
CB
C
CB
CB
MG
C33
O3B
O
ALA B:60 B:59 13.0 0.113 -162.4 -145.4 NA NA NA
ALA C:60 C:59 6.0 0.052 -176.3 175.9 NA NA NA
7ewa 1 P01116 91.12 1e-113 X-RAY
2021-12-29 ALA A:60 A:59 14.0 0.122 -165.1 -176.0 14.0 0.122 0.0 MG
GDP
05F
HOH
4.603
6.320
4.021
3.606
CB
CB
C
CB
MG
O3B
C36
O
ALA B:60 B:59 16.0 0.139 -172.8 -172.4 NA NA NA
ALA C:60 C:59 72.0 0.626 -117.3 158.7 NA NA NA
7ewb 1 P01116 91.12 1e-113 X-RAY
2021-12-29 ALA A:60 A:59 14.0 0.122 -170.3 177.1 14.0 0.122 0.0 MG
GDP
05I
HOH
4.716
6.326
4.023
3.748
CB
CB
C
CB
MG
O3B
CAR
O
ALA B:60 B:59 14.0 0.122 -174.3 176.3 NA NA NA
ALA C:60 C:59 16.0 0.139 -168.2 172.8 NA NA NA
4ql3 1 P01116 91.12 1e-113 X-RAY
2015-06-10 ALA A:60 A:59 33.0 0.287 -138.3 14.1 33.0 0.287 0.0 GDP
MG
HOH
5.778
4.512
2.671
HA
HB2
O
O3B
MG
O
6cu6 1 P01116 91.12 1e-113 X-RAY
2019-09-25 ALA A:60 A:59 26.0 0.226 -69.5 135.7 26.0 0.226 0.0 MG
GNP
HOH
5.955
3.998
2.770
CA
C
O
MG
O3G
O
ALA B:60 B:59 11.0 0.096 -76.3 -21.2 NA NA NA
ALA C:60 C:59 64.0 0.557 -48.9 360.0 NA NA NA
6quu 1 P01116 91.12 2e-113 X-RAY
2019-07-31 ALA A:77 A:59 7.0 0.061 -81.8 132.2 7.0 0.061 0.0 GCP
MG
HOH
3.787
5.061
2.110
HA
HA
H
O1G
MG
O
ALA B:77 B:59 7.0 0.061 -81.7 133.1 NA NA NA
4l8g 1 P01116 91.12 3e-113 X-RAY
2013-11-27 ALA A:60 A:59 75.0 0.652 -150.1 360.0 75.0 0.652 0.0 GDP
MG
HOH
5.847
4.108
2.671
HB2
HB2
O
O1B
MG
O
4ldj 1 P01116 91.12 3e-113 X-RAY
2014-06-04 ALA A:60 A:59 34.0 0.296 -135.4 14.0 34.0 0.296 0.0 GDP
MG
HOH
5.774
4.430
2.712
HA
HB2
O
O3B
MG
O
4nmm 1 P01116 91.12 3e-113 X-RAY
2014-06-04 ALA A:60 A:59 34.0 0.296 -132.7 22.0 34.0 0.296 0.0 MG
Y9Z
HOH
5.732
3.186
3.495
CB
O
N
MG
C13
O
7a1w 1 P01116-2 91.12 3e-113 X-RAY
2021-10-13 ALA A:60 A:59 13.0 0.113 -93.3 -22.6 13.0 0.113 0.0 GDP
MG
PO4
QWK
HOH
6.011
5.460
3.855
2.940
2.766
O
CA
O
O
O
O3B
MG
O1
N1
O
7a1x 1 P01116 91.12 3e-113 X-RAY
2021-10-13 ALA A:60 A:59 32.0 0.278 -135.2 16.7 32.0 0.278 0.0 GDP
MG
QWB
HOH
6.675
5.224
8.776
2.702
CA
CB
N
O
O3B
MG
C14
O
7a1y 1 P01116 91.12 3e-113 X-RAY
2021-10-13 ALA A:60 A:59 18.0 0.157 -107.5 -9.9 18.0 0.157 0.0 QWH
GDP
MG
HOH
2.430
6.553
5.459
2.993
O
O
CA
O
H15
O1B
MG
O
7a47 1 P01116-2 91.12 3e-113 X-RAY
2021-10-13 ALA A:60 A:59 34.0 0.296 T -58.8 144.4 34.0 0.296 0.0 GDP
QY5
HOH
3.295
3.276
2.983
CB
O
O
O3B
C9
O
ALA B:60 C:59 35.0 0.304 T -60.0 144.6 NA NA NA
ALA C:60 E:59 34.0 0.296 T -59.8 144.5 NA NA NA
5vp7 1 P01116 90.53 3e-113 X-RAY
2017-12-06 ALA A:60 A:59 13.0 0.113 -157.6 146.2 13.0 0.113 0.0 GDP
MG
HOH
6.270
4.703
3.765
CB
CB
CB
O3B
MG
O
ALA B:60 F:59 14.0 0.122 -159.4 145.5 NA NA NA
5vpi 1 P01116 90.53 3e-113 X-RAY
2017-12-06 ALA A:60 A:59 89.0 0.774 -80.8 360.0 89.0 0.774 0.0 GTP
MG
HOH
3.719
6.069
3.231
O
CA
C
O1G
MG
O
ALA B:60 B:59 91.0 0.791 -63.8 360.0 NA NA NA
5vpy 1 P01116 90.53 3e-113 X-RAY
2017-12-06 ALA A:60 NA:NA DO NA DO DO DO NA NA NA
ALA B:60 NA:NA DO NA DO DO DO NA NA NA
5vpz 1 P01116 90.53 3e-113 X-RAY
2017-12-06 ALA A:60 A:59 109.0 0.948 -64.9 360.0 109.0 0.948 0.0 MG
GSP
HOH
6.088
3.113
2.947
CA
C
O
MG
S1G
O
ALA B:60 B:59 107.0 0.93 -67.1 360.0 NA NA NA
5vq0 1 P01116 90.53 3e-113 X-RAY
2017-12-06 ALA A:60 A:59 26.0 0.226 -115.7 -47.1 26.0 0.226 0.0 MG
GDP
HOH
5.462
5.707
4.036
CA
O
CA
MG
O1B
O
ALA B:60 B:59 23.0 0.2 -114.3 -48.2 NA NA NA
6gj8 1 P01116 91.62 3e-113 X-RAY
2019-07-31 ALA A:60 A:59 6.0 0.052 -85.4 128.9 6.0 0.052 0.0 F0K
MG
GCP
HOH
8.806
6.099
4.113
2.706
N
CA
C
O
O1
MG
O2G
O
4tqa 1 P01116 91.62 3e-113 X-RAY
2015-06-10 ALA A:60 A:59 34.0 0.296 -135.6 11.4 34.0 0.296 0.0 GDP
MG
HOH
5.792
4.551
2.881
HA
HB2
O
O2B
MG
O
ALA B:60 B:59 34.0 0.296 -135.1 13.0 NA NA NA
5us4 1 P01116 91.12 3e-113 X-RAY
2017-03-22 ALA A:79 A:59 35.0 0.304 -138.1 360.0 35.0 0.304 0.0 GDP
MG
HOH
6.445
4.907
3.020
CA
CB
O
O3B
MG
O
ALA B:79 B:59 37.0 0.322 -143.7 360.0 NA NA NA
5usj 1 P01116 91.12 3e-113 X-RAY
2017-03-22 ALA A:79 A:59 28.0 0.243 -79.2 142.0 28.0 0.243 0.0 MG
GNP
HOH
5.973
4.000
2.878
CA
C
O
MG
O2G
O
ALA B:79 B:59 3.0 0.026 -74.9 138.7 NA NA NA
ALA C:79 C:59 7.0 0.061 -78.0 127.0 NA NA NA
ALA D:79 D:59 49.0 0.426 -77.9 137.6 NA NA NA
ALA E:79 E:59 7.0 0.061 -78.3 126.6 NA NA NA
ALA F:79 F:59 8.0 0.07 -76.0 131.1 NA NA NA
6gof 1 P01116 91.07 4e-113 X-RAY
2019-02-06 ALA A:59 A:59 5.0 0.043 -79.0 144.1 5.0 0.043 0.0 MG
GNP
MG
HOH
5.947
3.967
2.607
2.689
CA
C
O
O
MG
O1G
MG
O
6ws4 1 P01116 90.53 4e-113 X-RAY
2021-11-10 ALA A:60 A:59 16.0 0.139 -130.8 3.4 16.0 0.139 0.0 GDP
MG
HOH
6.545
5.196
3.208
CA
CB
O
O2B
MG
O
ALA B:60 B:59 17.0 0.148 -131.7 0.6 NA NA NA
ALA C:60 C:59 16.0 0.139 -128.2 -171.2 NA NA NA
ALA D:60 D:59 12.0 0.104 -127.1 -175.4 NA NA NA
5ufq 1 P01116 92.17 5e-113 X-RAY
2017-08-02 ALA A:59 A:59 32.0 0.278 -76.5 138.4 NA NA NA
ALA B:59 B:59 32.0 0.278 -72.0 141.6 32.0 0.278 0.0 GNP
MG
HOH
4.100
5.780
3.250
C
CA
O
O2G
MG
O
6e6f 1 P01116 92.17 5e-113 X-RAY
2019-07-31 ALA A:59 NA:NA DO NA DO DO DO NA NA NA
ALA B:59 NA:NA DO NA DO DO DO NA NA NA
6e6g 1 P01116 92.17 5e-113 X-RAY
2019-07-31 ALA A:59 A:59 12.0 0.104 T -56.5 136.9 12.0 0.104 0.0 GDP
NA
HOH
3.525
6.221
3.793
CB
CB
CA
O2B
NA
O
7eyx 1 P01116-2 91.07 5e-113 X-RAY
2021-06-16 ALA A:59 A:59 12.0 0.104 T -54.7 135.4 12.0 0.104 0.0 GDP
HOH
2.795
2.710
HB2
HA
O1B
O
7f0w 1 P01116-2 91.07 5e-113 X-RAY
2021-06-23 ALA A:59 A:59 24.0 0.209 S -122.1 167.1 24.0 0.209 0.0 GDP
HOH
6.056
2.614
HB3
O
O1B
O
6mqg 1 P01116 91.02 6e-113 X-RAY
2019-07-31 ALA A:57 A:59 53.0 0.461 S -114.4 -177.2 53.0 0.461 0.0 GDP
HOH
7.663
2.251
HB3
H
O1B
O
7rov 1 P01116 91.62 6e-113 X-RAY
2021-09-22 ALA A:60 A:59 19.0 0.165 -163.0 162.6 19.0 0.165 0.0 GCP
MG
HOH
3.905
4.519
3.486
CB
CB
CB
O1G
MG
O
ALA B:60 B:59 8.0 0.07 -166.8 158.2 NA NA NA
5kyk 1 P01116 91.62 9e-113 X-RAY
2017-04-12 ALA A:60 A:59 87.0 0.757 -112.4 -148.5 87.0 0.757 0.0 6ZD
HOH
4.932
7.512
C
CB
C32
O
ALA B:60 B:59 64.0 0.557 -102.4 -19.9 NA NA NA
ALA C:60 C:59 45.0 0.391 -113.7 -104.2 NA NA NA
5v71 1 P01116 91.62 9e-113 X-RAY
2017-08-23 ALA A:60 A:59 21.0 0.183 -152.2 -165.7 21.0 0.183 0.0 GDP
MG
8ZG
HOH
6.411
4.783
3.605
3.553
CA
CB
C
CB
O1B
MG
N03
O
ALA B:60 B:59 15.0 0.13 -128.0 0.7 NA NA NA
ALA C:60 C:59 20.0 0.174 -130.3 18.6 NA NA NA
ALA D:60 D:59 23.0 0.2 -141.2 -163.5 NA NA NA
ALA E:60 E:59 18.0 0.157 -121.7 10.6 NA NA NA
ALA F:60 F:59 13.0 0.113 -126.8 2.7 NA NA NA
5v9l 1 P01116 91.62 9e-113 X-RAY
2017-08-23 ALA A:60 A:59 17.0 0.148 -130.1 8.5 17.0 0.148 0.0 GDP
MG
91D
HOH
6.481
5.088
3.062
3.973
CB
CB
O
CB
O3B
MG
C21
O
ALA B:60 B:59 17.0 0.148 -152.0 -172.7 NA NA NA
ALA C:60 C:59 14.0 0.122 -132.6 3.4 NA NA NA
5v9o 1 P01116 91.62 9e-113 X-RAY
2017-08-23 ALA A:60 A:59 30.0 0.261 -150.5 -24.8 30.0 0.261 0.0 GDP
MG
91G
HOH
6.426
4.872
3.072
2.638
CB
CB
O
O
O1B
MG
N15
O
4epr 1 P01116 90.53 1e-112 X-RAY
2012-05-23 ALA A:60 A:59 5.0 0.043 -137.9 -55.8 5.0 0.043 0.0 GDP
MG
HOH
6.307
4.890
2.974
CA
CB
O
O3B
MG
O
6gj5 1 P01116 90.53 1e-112 X-RAY
2019-07-31 ALA A:60 A:59 22.0 0.191 -80.4 137.3 22.0 0.191 0.0 GCP
MG
F0N
HOH
3.932
5.849
9.712
3.024
C
CA
N
N
O1G
MG
C6
O
ALA B:60 B:59 47.0 0.409 -80.5 149.4 NA NA NA
6zl5 1 P01116 90.53 1e-112 X-RAY
2020-08-19 ALA A:60 A:59 78.0 0.678 -93.3 154.4 78.0 0.678 0.0 MG
GDP
F0K
HOH
6.191
6.666
9.009
2.785
CA
CA
N
O
MG
O1B
O1
O
4q21 1 P01112 85.64 2e-112 X-RAY
1992-07-15 ALA A:59 A:59 16.0 0.139 -166.9 145.2 16.0 0.139 0.0 MG
GDP
HOH
4.791
6.408
4.018
CB
CB
CB
MG
O3B
O
6w4e 2 P01116 91.57 5e-112 NMR
2020-04-15 ALA C:59 B:59 9.0 0.078 -70.1 155.9 9.0 0.078 0.0 GSP
MG
5.067
6.468
CA
N
O2G
MG
ALA D:59 C:59 3.0 0.026 -88.4 119.7 3.0 0.026 0.0 GSP
MG
4.046
6.695
C
N
O2G
MG
7rsc 1 P01116 91.57 5e-112 NMR
2021-09-22 ALA A:59 A:59 7.0 0.061 -80.0 110.6 7.0 0.061 0.0 GSP
MG
3.779
6.252
C
N
O2G
MG
ALA B:59 B:59 12.0 0.104 -73.6 158.2 12.0 0.104 0.0 GSP
MG
3.690
5.908
CA
N
O2G
MG
7rse 1 P01116 91.57 5e-112 NMR
2021-09-22 ALA A:59 A:59 14.0 0.122 -83.5 121.4 14.0 0.122 0.0 GSP
MG
3.439
6.255
CA
N
O2G
MG
ALA B:59 B:59 36.0 0.313 -74.0 104.7 36.0 0.313 0.0 GSP
MG
6.151
6.493
CA
CA
O2G
MG
6w4f 2 P01116 91.57 6e-112 NMR
2020-04-29 ALA C:58 B:59 20.0 0.174 -116.2 144.4 20.0 0.174 0.0 GDP
MG
6.857
6.056
CA
CB
O3B
MG
ALA D:58 C:59 24.0 0.209 -149.7 103.7 24.0 0.209 0.0 GDP
MG
6.734
6.178
CA
N
O3B
MG
6mqt 1 P01112 90.96 6e-112 X-RAY
2020-04-15 ALA A:60 A:59 3.0 0.026 -129.7 140.1 3.0 0.026 0.0 GDP
MG
HOH
5.397
4.812
3.061
HA
HB2
HA
HOB3
MG
O
ALA B:60 B:59 8.0 0.07 -140.4 117.6 NA NA NA
ALA C:60 C:59 6.0 0.052 -136.3 118.0 NA NA NA
ALA D:60 D:59 3.0 0.026 -126.8 139.4 NA NA NA
ALA E:60 E:59 3.0 0.026 -126.4 139.7 NA NA NA
ALA F:60 F:59 3.0 0.026 -128.5 142.3 NA NA NA
ALA G:60 G:59 17.0 0.148 -112.9 -73.1 NA NA NA
ALA H:60 H:59 19.0 0.165 -115.9 -69.0 NA NA NA
4dsn 1 P01116 91.57 6e-112 X-RAY
2012-04-25 ALA A:60 A:59 7.0 0.061 -78.6 148.3 7.0 0.061 0.0 GCP
MG
MG
EDO
HOH
4.190
5.899
2.506
7.410
2.875
C
CA
O
CB
O
O3G
MG
MG
O1
O
4dso 1 P01116 91.57 6e-112 X-RAY
2012-04-04 ALA A:60 A:59 3.0 0.026 -82.4 132.1 3.0 0.026 0.0 GSP
MG
GOL
HOH
3.759
5.982
8.051
2.808
C
CA
O
N
O2G
MG
O2
O
4dst 1 P01116 91.57 6e-112 X-RAY
2012-04-04 ALA A:60 A:59 7.0 0.061 -77.9 149.9 7.0 0.061 0.0 GCP
MG
GOL
DMS
MG
HOH
4.273
5.869
7.567
8.158
2.668
2.750
C
CA
O
CB
O
O
O3G
MG
O2
O
MG
O
4dsu 1 P01116 91.57 6e-112 X-RAY
2012-04-04 ALA A:60 A:59 22.0 0.191 -131.6 109.1 22.0 0.191 0.0 GDP
MG
HOH
6.629
5.242
3.450
CA
CB
CA
O1B
MG
O
5ocg 1 P01116 91.57 6e-112 X-RAY
2018-08-22 ALA A:60 A:59 5.0 0.043 -71.9 151.7 5.0 0.043 0.0 MG
GNP
9R5
MG
PEG
HOH
5.904
4.053
9.449
2.554
8.361
2.660
CA
C
N
O
O
O
MG
O3G
C12
MG
C2
O
6dzh 1 P01112 90.96 2e-111 X-RAY
2019-07-10 ALA A:59 A:59 18.0 0.157 -91.7 152.4 18.0 0.157 0.0 GDP
MG
HOH
6.717
5.647
3.001
CA
CA
O
O3B
MG
O
ALA B:59 B:59 126.0 1.0 -103.7 360.0 NA NA NA
ALA C:59 C:59 43.0 0.374 -94.5 160.9 NA NA NA
6e6c 1 P01112 90.96 2e-111 X-RAY
2019-07-31 ALA A:59 A:59 63.0 0.548 -83.1 149.2 63.0 0.548 0.0 MG
GNP
HOH
5.869
4.746
2.756
CA
C
O
MG
O3G
O
6e6p 1 P01112 90.96 2e-111 X-RAY
2019-07-31 ALA A:59 A:59 138.0 1.0 -83.7 360.0 138.0 1.0 0.0 GNP
MG
HOH
4.377
5.284
3.368
C
CA
C
O2G
MG
O
ALA B:59 B:59 83.0 0.722 -89.1 152.3 NA NA NA
ALA C:59 C:59 0.0 0.0 -81.3 138.9 NA NA NA
1agp 1 P01112 90.96 2e-111 X-RAY
1994-04-30 ALA A:59 A:59 3.0 0.026 -89.9 139.4 3.0 0.026 0.0 MG
GNP
HOH
5.334
3.989
7.068
CA
C
CA
MG
O3G
O
421p 1 P01112 90.96 2e-111 X-RAY
1994-01-31 ALA A:59 A:59 0.0 0.0 -84.5 138.6 0.0 0.0 0.0 MG
GNP
HOH
5.899
3.910
2.763
CA
C
O
MG
O3G
O
6zj0 1 P01112 90.96 3e-111 X-RAY
2020-08-19 ALA A:60 A:59 32.0 0.278 -80.3 145.2 32.0 0.278 0.0 MG
GCP
EZZ
HOH
4.816
3.447
7.486
2.250
HA
HA
H
H
MG
O3G
O22
O
1clu 1 P01112 90.96 3e-111 X-RAY
1999-05-28 ALA A:59 A:59 58.0 0.504 -68.2 151.7 58.0 0.504 0.0 MG
DBG
HOH
5.744
4.754
3.383
CA
C
O
MG
O1G
O
1jai 1 P01112 90.96 3e-111 X-RAY
1997-07-23 ALA A:59 A:59 4.0 0.035 -90.7 140.2 4.0 0.035 0.0 MN
GCP
HOH
6.059
4.759
2.976
CA
CA
O
MN
O2G
O
1plj 1 P01112 90.96 3e-111 X-RAY
1994-07-31 ALA A:59 A:59 52.0 0.452 -69.8 171.6 52.0 0.452 0.0 MG
CAG
5.428
4.231
CA
C
MG
O2G
1pll 1 P01112 90.96 3e-111 X-RAY
1994-07-31 ALA A:59 A:59 27.0 0.235 -59.4 153.4 27.0 0.235 0.0 GDP
3.832
C
O2B
821p 1 P01112 90.96 3e-111 X-RAY
1994-01-31 ALA A:59 A:59 9.0 0.078 -80.1 140.0 9.0 0.078 0.0 MG
GNP
HOH
5.846
4.177
2.427
CA
C
O
MG
O3G
H2
7l0g 1 P01112 90.96 3e-111 X-RAY
2021-03-24 ALA A:60 A:59 17.0 0.148 -79.0 134.1 4.0 0.035 0.113 C:None:0.113
GSP
MG
HOH
3.899
5.937
3.004
C
CA
O
O2G
MG
O
ALA B:60 B:59 16.0 0.139 -80.0 134.7 NA NA NA
ALA E:60 E:59 18.0 0.157 -81.5 135.1 NA NA NA
ALA G:60 G:59 16.0 0.139 -80.8 133.2 NA NA NA
6wgn 1 P01116 89.35 5e-111 X-RAY
2020-10-14 ALA A:59 A:59 48.0 0.417 -152.2 164.5 31.0 0.27 0.147 E:None:0.148
GNP
MG
HOH
3.734
4.860
2.892
CB
CB
O
O1G
MG
O
ALA B:59 B:59 52.0 0.452 -144.3 165.1 NA NA NA
ALA C:59 C:59 51.0 0.443 -148.5 168.7 NA NA NA
4l9s 1 P01112 90.96 5e-111 X-RAY
2013-11-27 ALA A:64 A:59 29.0 0.252 -134.5 24.2 29.0 0.252 0.0 GDP
MG
HOH
5.640
4.245
2.898
HA
HB2
HA
O1B
MG
O
4l9w 1 P01112 90.96 5e-111 X-RAY
2013-11-27 ALA A:64 A:59 7.0 0.061 -84.7 132.8 7.0 0.061 0.0 GNP
MG
HOH
3.855
5.981
2.799
C
CA
O
O3G
MG
O
1jah 1 P01112 90.96 7e-111 X-RAY
1997-07-23 ALA A:59 A:59 5.0 0.043 -95.1 149.5 5.0 0.043 0.0 MG
GCP
HOH
6.211
4.695
2.888
CA
CA
O
MG
O3G
O
1plk 1 P01112 90.96 7e-111 X-RAY
1994-07-31 ALA A:59 A:59 27.0 0.235 -113.0 117.9 27.0 0.235 0.0 MG
GTP
4.201
2.763
N
CA
MG
O2G
7rpz 1 P01116-2 89.35 8e-111 X-RAY
2021-12-22 ALA A:60 A:59 17.0 0.148 -168.0 176.9 17.0 0.148 0.0 GDP
6IC
MG
HOH
6.138
3.928
4.607
2.679
CB
C
CB
O
O3B
C11
MG
O
7rt1 1 P01116-2 89.35 8e-111 X-RAY
2021-12-22 ALA A:60 A:59 16.0 0.139 -170.4 176.9 16.0 0.139 0.0 GDP
MG
7L8
7L8
HOH
6.185
4.613
3.790
7.998
2.817
CB
CB
C
O
O
O3B
MG
C17
C27
O
7rt2 1 P01116-2 89.35 8e-111 X-RAY
2021-12-22 ALA A:60 A:59 18.0 0.157 -165.9 -177.2 18.0 0.157 0.0 GDP
MG
7NL
EDO
HOH
6.325
4.799
4.039
2.745
2.879
CB
CB
C
N
O
O3B
MG
C17
HO2
O
7rt3 1 P01116-2 89.35 8e-111 X-RAY
2021-12-22 ALA A:60 A:59 22.0 0.191 -167.6 175.5 22.0 0.191 0.0 GDP
7NZ
MG
HOH
6.264
4.202
4.723
2.579
CB
C
CB
O
O3B
C09
MG
O
7rt4 1 P01116-2 89.35 8e-111 X-RAY
2021-12-22 ALA A:60 A:59 18.0 0.157 -170.0 179.1 18.0 0.157 0.0 GDP
MG
7IZ
HOH
6.176
4.497
3.892
3.595
CB
CB
C
CB
O3B
MG
C35
O
7rt5 1 P01116-2 89.35 8e-111 X-RAY
2021-12-22 ALA A:60 A:59 16.0 0.139 -170.0 176.6 16.0 0.139 0.0 GDP
7OE
MG
HOH
6.162
3.959
4.597
2.827
CB
C
CB
O
O3B
C11
MG
O
6epl 1 P01116 88.76 1e-110 X-RAY
2019-02-06 ALA A:60 R:59 31.0 0.27 T -54.5 137.2 3.0 0.026 0.244 B:Q07889:0.243
HOH
3.425
N
O
6epm 1 P01116 88.76 1e-110 X-RAY
2019-02-06 ALA A:60 R:59 33.0 0.287 T -44.4 132.1 2.0 0.017 0.27 B:Q07889:0.27
HOH
3.396
N
O
6epn 1 P01116 88.76 1e-110 X-RAY
2019-02-06 ALA A:60 R:59 33.0 0.287 T -41.5 131.5 3.0 0.026 0.261 B:Q07889:0.261
HOH
3.403
N
O
6epo 1 P01116 88.76 1e-110 X-RAY
2019-02-06 ALA A:60 R:59 33.0 0.287 T -39.5 128.8 2.0 0.017 0.27 B:Q07889:0.27
HOH
3.360
N
O
6epp 1 P01116 88.76 1e-110 X-RAY
2019-02-06 ALA A:60 R:59 35.0 0.304 T -40.0 128.6 2.0 0.017 0.287 B:Q07889:0.287
HOH
3.369
N
O
6t5v 1 P01116 89.35 4e-110 X-RAY
2020-02-19 ALA A:59 A:59 29.0 0.252 -161.6 -162.1 29.0 0.252 0.0 MG
GDP
MKZ
HOH
4.426
6.085
3.148
2.739
CB
CB
O
O
MG
O3B
H20
O
4lrw 1 P01116 89.35 5e-110 X-RAY
2013-11-27 ALA A:60 A:59 72.0 0.626 -137.8 360.0 72.0 0.626 0.0 MG
GDP
HOH
5.330
6.531
3.768
CB
CA
C
MG
O2B
O
ALA B:60 B:59 72.0 0.626 -141.3 360.0 72.0 0.626 0.0 MG
GDP
HOH
5.390
6.626
3.758
CB
CA
O
MG
O2B
O
4luc 1 P01116 89.35 5e-110 X-RAY
2013-11-27 ALA A:60 A:59 20.0 0.174 -158.7 53.1 20.0 0.174 0.0 CA
20G
GDP
HOH
4.027
4.071
5.767
2.621
HB2
HA
HB2
HA
CA
H18A
O3B
O
ALA B:60 B:59 19.0 0.165 -158.7 52.4 19.0 0.165 0.0 CA
20G
GDP
HOH
4.013
4.708
5.752
2.693
HB2
HA
HB2
HA
CA
H21
O1B
O
4lv6 1 P01116 89.35 5e-110 X-RAY
2013-11-27 ALA A:60 A:59 24.0 0.209 -155.7 137.1 24.0 0.209 0.0 CA
20H
GDP
HOH
4.035
2.578
5.709
2.708
HB2
HA
HB2
O
CA
O18
O2B
O
ALA B:60 B:59 22.0 0.191 -158.6 133.0 22.0 0.191 0.0 CA
20H
GDP
HOH
3.947
2.638
5.631
2.721
HB2
HA
HB2
O
CA
O18
O1B
O
4lyf 1 P01116 89.35 5e-110 X-RAY
2013-11-27 ALA A:60 A:59 16.0 0.139 -100.4 -7.3 16.0 0.139 0.0 GDP
HOH
5.392
2.871
HB2
HB2
O1B
O
ALA B:60 B:59 63.0 0.548 T -60.0 135.3 50.0 0.435 0.113 C:P01116:0.113
21C
GDP
HOH
5.923
6.931
4.937
N
HB2
HB2
H251
O3B
O
ALA C:60 C:59 38.0 0.33 T -56.6 130.9 38.0 0.33 0.0 GDP
HOH
2.781
2.825
HB3
HA
O3B
O
4lyh 1 P01116 89.35 5e-110 X-RAY
2013-11-27 ALA A:60 A:59 18.0 0.157 -97.1 -14.4 18.0 0.157 0.0 GDP
HOH
5.361
2.866
HB2
HB2
O1B
O
ALA B:60 B:59 56.0 0.487 T -61.8 137.1 24.0 0.209 0.278 C:P01116:0.278
21F
GDP
GDP
HOH
6.778
7.438
9.959
2.669
N
HB2
O
O
I04
O3B
HN1
O
ALA C:60 C:59 52.0 0.452 T -49.3 -24.8 52.0 0.452 0.0 21F
GDP
HOH
2.461
2.804
2.531
O
HB2
HA
H201
O3B
O
4lyj 1 P01116 89.35 5e-110 X-RAY
2013-11-27 ALA A:60 A:59 11.0 0.096 T -50.7 128.9 11.0 0.096 0.0 MG
21F
GDP
HOH
4.195
6.523
6.369
2.851
CB
C
CB
O
MG
O19
O1B
O
4m1o 1 P01116 89.35 5e-110 X-RAY
2013-11-27 ALA A:60 A:59 17.0 0.148 -103.4 -0.7 17.0 0.148 0.0 GDP
HOH
5.359
2.695
HB2
HB2
O2B
O
ALA B:60 B:59 62.0 0.539 T -67.4 134.7 NA NA NA
ALA C:60 C:59 52.0 0.452 -51.7 111.4 NA NA NA
4m1s 1 P01116 89.35 5e-110 X-RAY
2013-11-27 ALA A:60 A:59 18.0 0.157 -95.9 -12.0 18.0 0.157 0.0 GDP
HOH
5.327
2.872
HB2
HB2
O1B
O
ALA B:60 B:59 70.0 0.609 T -56.0 -30.2 NA NA NA
ALA C:60 C:59 92.0 0.8 -66.6 360.0 NA NA NA
4m1t 1 P01116 89.35 5e-110 X-RAY
2013-11-27 ALA A:60 A:59 13.0 0.113 -98.8 -6.6 13.0 0.113 0.0 GDP
HOH
5.326
2.842
HB2
HB2
O1B
O
ALA B:60 B:59 49.0 0.426 T -59.3 134.7 NA NA NA
ALA C:60 C:59 50.0 0.435 T -51.3 -42.5 NA NA NA
4m1w 1 P01116 89.35 5e-110 X-RAY
2013-11-27 ALA A:60 A:59 16.0 0.139 -100.7 -12.4 16.0 0.139 0.0 MG
21R
GDP
HOH
6.321
4.326
5.271
2.758
HB2
HB3
HB2
HB2
MG
H253
O1B
O
ALA B:60 B:59 52.0 0.452 T -60.3 133.4 NA NA NA
ALA C:60 C:59 51.0 0.443 G -57.8 -22.0 NA NA NA
4m1y 1 P01116 89.35 5e-110 X-RAY
2013-11-27 ALA A:60 A:59 19.0 0.165 -101.5 -13.9 19.0 0.165 0.0 GDP
HOH
5.282
2.830
HB2
HB2
O2B
O
ALA B:60 B:59 51.0 0.443 T -56.6 134.8 NA NA NA
ALA C:60 C:59 49.0 0.426 T -52.4 -39.8 NA NA NA
4m21 1 P01116 89.35 5e-110 X-RAY
2013-11-27 ALA A:60 A:59 32.0 0.278 -110.5 -4.1 32.0 0.278 0.0 GDP
HOH
5.360
2.147
HB2
H
O1B
O
ALA B:60 B:59 113.0 0.983 -52.6 360.0 NA NA NA
ALA C:60 C:59 88.0 0.765 -61.1 360.0 NA NA NA
4m22 1 P01116 89.35 5e-110 X-RAY
2013-11-27 ALA A:60 A:59 61.0 0.53 -171.7 360.0 61.0 0.53 0.0 MG
GDP
HOH
3.414
5.179
2.591
HB2
HB2
HB2
MG
O1B
O
ALA B:60 B:59 18.0 0.157 -132.3 -5.8 NA NA NA
ALA C:60 C:59 26.0 0.226 -145.1 -175.1 NA NA NA
5f2e 1 P01116 89.35 5e-110 X-RAY
2016-01-13 ALA A:60 A:59 23.0 0.2 -157.3 -173.2 23.0 0.2 0.0 MG
5UT
GDP
HOH
4.679
3.378
6.378
2.727
CB
O
CB
O
MG
C17
O3B
O
5v6s 1 P01116 89.35 5e-110 X-RAY
2017-06-28 ALA A:60 A:59 19.0 0.165 -166.1 -176.9 19.0 0.165 0.0 GDP
MG
8YD
HOH
5.279
3.708
2.783
2.904
HB2
HB2
HA
HB2
O3B
MG
C25
O
5v6v 1 P01116 89.35 5e-110 X-RAY
2017-06-28 ALA A:60 A:59 25.0 0.217 -152.2 153.8 25.0 0.217 0.0 GDP
CA
8YA
HOH
5.638
3.822
2.582
2.744
HB2
HB2
O
O
O2B
CA
H181
O
ALA B:60 B:59 26.0 0.226 -149.6 158.8 26.0 0.226 0.0 GDP
CA
8YA
HOH
5.631
3.814
2.422
3.028
HB2
HB2
O
HB2
O1B
CA
H181
O
5v9u 1 P01116 89.35 5e-110 X-RAY
2018-02-07 ALA A:60 A:59 22.0 0.191 -165.7 -114.6 22.0 0.191 0.0 CA
91S
GDP
HOH
4.295
3.403
5.909
3.543
CB
O
CB
CB
CA
C16
O1B
O
ALA B:60 B:59 23.0 0.2 -160.1 -118.7 NA NA NA
5yxz 1 P01116 89.35 5e-110 X-RAY
2018-04-18 ALA A:60 A:59 32.0 0.278 -150.8 -27.7 32.0 0.278 0.0 MG
GDP
94C
HOH
4.536
6.134
3.182
2.619
CB
CB
O
O
MG
O3B
N11
O
5yy1 1 P01116 89.35 5e-110 X-RAY
2018-04-18 ALA A:60 A:59 19.0 0.165 -162.1 -153.6 19.0 0.165 0.0 MG
GDP
94F
HOH
4.367
6.118
3.599
3.288
CB
CB
CA
O
MG
O3B
C12
O
6ark 1 P01116 89.35 5e-110 X-RAY
2018-01-31 ALA A:60 A:59 17.0 0.148 -144.3 126.3 17.0 0.148 0.0 GDP
MG
BQD
HOH
5.681
4.292
8.690
2.831
HA
HB2
HA
HB2
O3B
MG
C07
O
6b0v 1 P01116 89.35 5e-110 X-RAY
2018-05-16 ALA A:60 A:59 22.0 0.191 -143.1 171.4 22.0 0.191 0.0 CA
C8G
GDP
HOH
5.805
3.326
7.586
2.914
CB
O
CA
O
CA
C6
O1B
O
ALA B:60 B:59 22.0 0.191 -138.5 176.4 NA NA NA
6b0y 1 P01116 89.35 5e-110 X-RAY
2018-05-16 ALA A:60 A:59 25.0 0.217 -165.0 -114.1 25.0 0.217 0.0 CA
8ZG
GDP
HOH
4.358
3.268
6.047
3.593
CB
O
CB
CB
CA
C04
O1B
O
ALA B:60 B:59 23.0 0.2 -160.0 -119.7 NA NA NA
6n2j 1 P01116 89.35 5e-110 X-RAY
2018-12-12 ALA A:60 A:59 16.0 0.139 -162.9 -157.5 16.0 0.139 0.0 GDP
MG
K9M
HOH
6.006
4.377
3.641
3.271
CB
CB
CA
O
O2B
MG
O29
O
6n2k 1 P01116 89.35 5e-110 X-RAY
2018-12-12 ALA A:60 A:59 18.0 0.157 -165.5 -162.3 18.0 0.157 0.0 GDP
MG
K9J
HOH
6.032
4.350
3.594
3.319
CB
CB
CA
CB
O2B
MG
O25
O
6tam 1 P01116 89.35 5e-110 X-RAY
2020-04-08 ALA A:60 A:59 18.0 0.157 -150.2 -125.5 18.0 0.157 0.0 GDP
MG
MZQ
HOH
6.159
4.718
3.881
3.860
CB
CB
O
CB
O3B
MG
C10
O
6tan 1 P01116 89.35 5e-110 X-RAY
2020-04-08 ALA A:60 A:59 20.0 0.174 -165.1 -139.3 20.0 0.174 0.0 GDP
MG
MZN
HOH
5.983
4.455
3.843
3.667
CB
CB
O
CB
O3B
MG
C13
O
6usx 1 P01116 89.35 5e-110 X-RAY
2020-04-22 ALA A:60 A:59 19.0 0.165 -158.2 -164.9 19.0 0.165 0.0 GDP
MG
M1R
HOH
5.683
4.022
2.682
2.899
HB1
HB1
HA
HB1
O2B
MG
O31
O
ALA B:60 B:59 18.0 0.157 -171.7 -159.3 NA NA NA
6usz 1 P01116 89.35 5e-110 X-RAY
2020-04-22 ALA A:60 A:59 16.0 0.139 -160.0 -131.1 16.0 0.139 0.0 GDP
MG
QH4
HOH
6.145
4.535
3.435
3.549
CB
CB
O
CB
O2B
MG
C17
O
6ut0 1 P01116 89.35 5e-110 X-RAY
2020-04-22 ALA A:60 A:59 18.0 0.157 -163.5 -127.3 18.0 0.157 0.0 GDP
MG
M1X
HOH
5.324
3.757
2.883
2.862
HB2
HB2
HA
HB2
O1B
MG
O18
O
ALA B:60 B:59 14.0 0.122 -153.7 -151.6 NA NA NA
ALA C:60 C:59 18.0 0.157 -160.8 -130.8 NA NA NA
ALA D:60 D:59 16.0 0.139 -155.4 -133.9 NA NA NA
6oim 1 P01116 89.35 7e-110 X-RAY
2019-11-06 ALA A:73 A:59 26.0 0.226 -154.2 -24.5 26.0 0.226 0.0 MG
GDP
MOV
HOH
4.620
6.268
3.155
2.624
CB
CB
O
O
MG
O2B
C19
O
6p8w 1 P01116 89.35 7e-110 X-RAY
2019-08-28 ALA A:73 A:59 31.0 0.27 -142.9 -115.3 31.0 0.27 0.0 CA
GDP
O67
HOH
4.919
6.671
2.898
3.880
CB
CB
O
CB
CA
O2B
N09
O
ALA B:73 B:59 32.0 0.278 -143.3 -115.5 NA NA NA
6p8x 1 P01116 89.35 7e-110 X-RAY
2019-08-28 ALA A:73 A:59 31.0 0.27 -143.1 -115.3 31.0 0.27 0.0 CA
GDP
O5V
HOH
4.841
6.688
3.257
3.786
CB
CB
O
CB
CA
O3B
N09
O
ALA B:73 B:59 31.0 0.27 -148.3 -125.3 NA NA NA
ALA C:73 C:59 32.0 0.278 -149.8 -115.4 NA NA NA
ALA D:73 D:59 30.0 0.261 -138.7 -126.7 NA NA NA
6p8y 1 P01116 89.35 7e-110 X-RAY
2019-08-28 ALA A:73 A:59 29.0 0.252 -146.3 11.5 29.0 0.252 0.0 MG
GDP
O5Y
HOH
4.833
6.047
3.549
3.330
CB
CB
O
CB
MG
O1B
N05
O
ALA B:73 B:59 40.0 0.348 -162.1 -145.4 NA NA NA
6p8z 1 P01116 89.35 7e-110 X-RAY
2019-08-28 ALA A:73 A:59 23.0 0.2 -136.6 -22.4 23.0 0.2 0.0 CA
GDP
O5S
HOH
4.860
6.660
3.424
2.998
CB
CB
O
O
CA
O1B
N05
O
ALA B:73 B:59 21.0 0.183 -110.7 -16.3 NA NA NA
6pgo 1 P01116 89.35 7e-110 X-RAY
2019-12-25 ALA A:73 A:59 14.0 0.122 -154.3 -171.0 14.0 0.122 0.0 MG
GDP
OJ1
HOH
4.637
6.316
3.420
3.760
CB
CB
C
CB
MG
O1B
N05
O
ALA B:73 NA:NA DO NA DO DO DO NA NA NA
6pgp 1 P01116 89.35 7e-110 X-RAY
2019-12-25 ALA A:73 A:59 25.0 0.217 -149.3 -136.5 25.0 0.217 0.0 GDP
CA
OHY
HOH
6.749
4.971
3.711
3.900
CB
CB
O
CB
O2B
CA
C24
O
ALA B:73 B:59 25.0 0.217 -147.1 -132.3 NA NA NA
6t5b 1 P01116 88.76 9e-110 X-RAY
2020-02-26 ALA A:60 A:59 14.0 0.122 -156.0 -128.9 14.0 0.122 0.0 MG
GDP
O7K
HOH
4.597
6.237
3.488
2.961
CB
CB
O
N
MG
O1B
C3
O
6t5u 1 A0A024RAV5 89.82 2e-109 X-RAY
2020-02-19 ALA A:60 A:59 22.0 0.191 -166.9 -139.5 22.0 0.191 0.0 MG
GDP
MKW
HOH
4.368
5.823
3.070
3.426
CB
CB
O
CB
MG
O3B
C16
O
ALA B:60 B:59 23.0 0.2 -155.6 -144.3 NA NA NA
1ioz 1 P01112 90.06 6e-107 X-RAY
2001-10-03 ALA A:59 A:59 29.0 0.252 -120.1 -16.9 29.0 0.252 0.0 GDP
HOH
6.236
3.913
O
CB
O2B
O
1q21 1 P01112 90.06 6e-107 X-RAY
1992-07-15 ALA A:59 A:59 14.0 0.122 -148.8 142.5 14.0 0.122 0.0 MG
GDP
HOH
4.660
6.357
3.656
CB
CB
CB
MG
O3B
O
6q21 1 P01112 90.06 6e-107 X-RAY
1992-07-28 ALA A:59 A:59 13.0 0.113 -142.6 162.4 13.0 0.113 0.0 MG
GCP
HOH
4.743
3.328
2.756
CB
CB
O
MG
O1G
O
ALA B:59 B:59 3.0 0.026 -85.2 125.0 3.0 0.026 0.0 MG
GCP
HOH
6.031
4.128
3.239
CA
C
O
MG
O3G
O
ALA C:59 C:59 4.0 0.035 -86.9 132.1 4.0 0.035 0.0 MG
GCP
HOH
5.932
3.925
2.682
CA
C
O
MG
O1G
O
ALA D:59 D:59 13.0 0.113 -84.3 100.2 13.0 0.113 0.0 MG
GCP
HOH
5.190
4.105
2.358
CA
C
O
MG
O1G
O
2q21 1 P01112 89.47 6e-107 X-RAY
1992-07-15 ALA A:59 A:59 19.0 0.165 -152.9 158.3 19.0 0.165 0.0 MG
GDP
HOH
4.825
6.436
3.561
CB
CB
CA
MG
O3B
O
5x9s 1 P01112 84.95 7e-107 X-RAY
2017-08-30 ALA A:65 A:59 0.0 0.0 -77.0 142.5 0.0 0.0 0.0 MG
GNP
HOH
5.829
3.972
2.682
CA
C
O
MG
O3G
O
6ms9 1 P01116 91.72 9e-107 X-RAY
2020-04-15 ALA A:59 NA:NA DO NA DO DO DO NA NA NA
ALA B:59 B:59 147.0 1.0 -124.8 360.0 NA NA NA
ALA C:59 A:59 44.0 0.383 G -52.1 -23.2 NA NA NA
6v5l 1 P01116 91.72 9e-107 NMR
2019-12-18 ALA A:59 A:59 17.0 0.148 -83.9 -58.4 17.0 0.148 0.0 GDP
MG
QPD
5.475
4.393
6.619
HA
HA
H
O3B
MG
H13
7lgi 1 P01116 91.72 9e-107 NMR
2021-07-21 ALA A:59 A:59 36.0 0.313 -90.1 -50.9 36.0 0.313 0.0 GDP
MG
P2Z
6.118
4.652
6.999
HA
HA
H
O3B
MG
H16
4lpk 1 P01116 91.72 1e-106 X-RAY
2013-11-27 ALA A:60 A:59 22.0 0.191 -131.8 138.0 22.0 0.191 0.0 GDP
CA
NA
HOH
5.885
4.510
2.453
2.920
HA
HB2
O
O
O3B
CA
NA
O
ALA B:60 B:59 21.0 0.183 -121.8 -10.5 NA NA NA
4obe 1 P01116 91.72 1e-106 X-RAY
2014-06-04 ALA A:60 A:59 34.0 0.296 -131.7 14.9 34.0 0.296 0.0 GDP
MG
HOH
5.730
4.686
2.813
HA
HB2
O
O3B
MG
O
ALA B:60 B:59 34.0 0.296 -131.8 15.3 NA NA NA
6mbt 1 P01116 91.72 1e-106 X-RAY
2019-07-31 ALA A:60 A:59 35.0 0.304 -134.2 11.4 35.0 0.304 0.0 GDP
MG
HOH
5.714
4.615
2.956
HA
HB2
H
O2B
MG
O
ALA B:60 B:59 35.0 0.304 -136.0 9.7 NA NA NA
6mbu 1 P01116 91.72 1e-106 X-RAY
2019-07-31 ALA A:60 A:59 15.0 0.13 -130.3 4.2 15.0 0.13 0.0 MG
GDP
GOL
HOH
4.534
5.786
7.937
2.804
HB2
HA
HB1
HB3
MG
O3B
HO2
O
ALA B:60 B:59 70.0 0.609 -126.6 360.0 NA NA NA
6ob2 1 P01116 91.72 1e-106 X-RAY
2019-10-16 ALA A:60 A:59 7.0 0.061 -99.6 126.1 7.0 0.061 0.0 GNP
MG
HOH
4.155
6.092
3.644
C
CA
CA
O3G
MG
O
ALA C:60 C:59 7.0 0.061 -98.7 127.9 NA NA NA
6v65 3 P01116 91.72 1e-106 X-RAY
2020-07-15 ALA C:60 C:59 3.0 0.026 -91.0 116.7 3.0 0.026 0.0 GNP
MG
HOH
4.168
5.934
7.510
C
CA
C
O2G
MG
O
6vc8 1 P01116 91.72 1e-106 X-RAY
2021-02-10 ALA A:60 A:59 56.0 0.487 -94.3 163.5 56.0 0.487 0.0 GNP
MG
HOH
4.307
5.863
2.833
C
CA
O
O2G
MG
O
ALA B:60 B:59 40.0 0.348 -93.0 158.3 NA NA NA
ALA C:60 C:59 106.0 0.922 -92.4 360.0 NA NA NA
6vjj 1 P01116 91.72 1e-106 X-RAY
2020-11-25 ALA A:60 A:59 1.0 0.009 -73.7 133.5 1.0 0.009 0.0 MG
GNP
CL
EDO
MPD
HOH
5.827
3.959
7.624
8.344
9.399
2.733
CA
C
CB
O
O
O
MG
O3G
CL
O2
O2
O
6xhb 1 P01116 91.72 1e-106 X-RAY
2021-01-13 ALA A:60 A:59 7.0 0.061 -96.5 130.8 7.0 0.061 0.0 GNP
MG
HOH
4.157
5.848
2.933
C
CA
N
O1G
MG
O
6yxw 1 P01116 92.22 2e-106 X-RAY
2020-07-08 ALA A:62 A:59 14.0 0.122 -161.8 150.5 12.0 0.104 0.018 B:None:0.017
GDP
MG
HOH
6.193
4.778
3.068
CB
CB
O
O2B
MG
O
ALA C:62 C:59 16.0 0.139 -153.6 152.6 NA NA NA
7ny8 1 P01116 92.22 2e-106 X-RAY
2021-07-07 ALA A:62 A:59 32.0 0.278 -112.6 2.8 32.0 0.278 0.0 GDP
MG
HOH
6.355
5.111
2.847
CA
CA
N
O2B
MG
O
ALA B:62 B:59 26.0 0.226 -107.7 -46.9 NA NA NA
7q9u 1 P01116-2 92.22 4e-106 X-RAY
2022-01-26 ALA A:59 AAA:59 54.0 0.47 T -43.6 -49.6 54.0 0.47 0.0 GDP
HOH
4.251
3.698
CB
N
O1B
O
ALA B:59 BBB:59 50.0 0.435 T -46.8 -48.5 NA NA NA
6god 1 P01116 91.67 4e-106 X-RAY
2019-02-06 ALA A:59 A:59 4.0 0.035 -75.0 151.7 4.0 0.035 0.0 MG
GNP
GOL
MG
HOH
5.958
3.795
9.057
2.391
2.754
CA
C
O
O
O
MG
O3G
C2
MG
O
5uqw 1 P01116 91.12 4e-106 X-RAY
2017-03-22 ALA A:79 A:59 16.0 0.139 -137.0 9.8 16.0 0.139 0.0 MG
GDP
HOH
5.274
6.816
2.732
CB
CA
O
MG
O3B
O
ALA B:79 B:59 70.0 0.609 -149.9 360.0 NA NA NA
6mnx 1 P01116 91.12 4e-106 X-RAY
2020-04-15 ALA A:59 A:59 11.0 0.096 -88.9 147.0 11.0 0.096 0.0 GTP
MG
HOH
3.317
4.959
2.431
HA
HA
H
O3G
MG
O
ALA B:59 B:59 13.0 0.113 -78.4 152.6 NA NA NA
ALA C:59 C:59 16.0 0.139 -77.2 146.5 NA NA NA
ALA D:59 D:59 12.0 0.104 -93.2 141.5 NA NA NA
ALA E:59 E:59 9.0 0.078 -88.3 140.3 NA NA NA
ALA F:59 F:59 26.0 0.226 -78.1 128.2 NA NA NA
4tq9 1 P01116 91.62 4e-106 X-RAY
2015-06-10 ALA A:60 A:59 32.0 0.278 -133.4 13.4 32.0 0.278 0.0 GDP
MG
HOH
5.753
4.640
2.663
HA
HB1
O
O1B
MG
O
ALA B:60 B:59 33.0 0.287 -135.6 14.6 NA NA NA
6ws2 1 P01116 91.12 5e-106 X-RAY
2021-11-10 ALA A:60 A:59 16.0 0.139 -126.3 0.3 16.0 0.139 0.0 GDP
MG
HOH
6.479
5.224
3.148
CA
CB
O
O2B
MG
O
ALA B:60 B:59 15.0 0.13 -126.4 1.0 NA NA NA
ALA C:60 C:59 15.0 0.13 -120.4 -163.5 NA NA NA
ALA D:60 D:59 8.0 0.07 -119.2 -172.4 NA NA NA
6f76 1 P01116 91.12 5e-106 X-RAY
2018-08-08 ALA A:63 B:59 11.0 0.096 -80.8 143.9 11.0 0.096 0.0 MG
GNP
HOH
5.965
3.976
3.066
CA
C
O
MG
O3G
O
ALA B:63 A:59 9.0 0.078 -80.6 141.8 9.0 0.078 0.0 MG
GNP
HOH
6.218
3.958
3.052
CA
C
N
MG
O3G
O
ALA C:63 C:59 45.0 0.391 -81.6 143.4 45.0 0.391 0.0 MG
GNP
HOH
5.997
3.824
4.870
CA
C
N
MG
O2G
O
ALA D:63 D:59 20.0 0.174 -82.4 144.8 20.0 0.174 0.0 GNP
MG
HOH
3.871
5.913
2.968
C
CA
O
O3G
MG
O
ALA E:63 E:59 11.0 0.096 -82.5 143.0 11.0 0.096 0.0 MG
GNP
HOH
6.153
3.908
4.962
CA
C
N
MG
O2G
O
ALA F:63 F:59 25.0 0.217 -80.7 144.2 25.0 0.217 0.0 MG
GNP
HOH
5.506
3.792
9.197
CA
C
O
MG
O2G
O
6fa1 1 P01116 91.12 5e-106 X-RAY
2018-08-22 ALA A:63 B:59 13.0 0.113 -77.9 142.4 13.0 0.113 0.0 MG
GNP
HOH
5.881
3.957
2.953
CA
C
O
MG
O3G
O
6fa1 3 P01116 91.12 5e-106 X-RAY
2018-08-22 ALA E:63 E:59 11.0 0.096 -78.1 141.8 11.0 0.096 0.0 MG
GNP
HOH
5.849
3.809
3.048
CA
C
O
MG
O2G
O
6fa4 1 P01116 91.12 5e-106 X-RAY
2018-08-22 ALA A:63 B:59 11.0 0.096 -83.1 138.8 11.0 0.096 0.0 MG
GNP
HOH
5.979
4.050
2.964
CA
C
O
MG
O3G
O
6fa4 2 P01116 91.12 5e-106 X-RAY
2018-08-22 ALA B:63 A:59 9.0 0.078 -80.2 137.3 NA NA NA
ALA C:63 C:59 24.0 0.209 -81.7 139.4 NA NA NA
ALA D:63 D:59 25.0 0.217 -80.8 139.2 NA NA NA
ALA E:63 E:59 24.0 0.209 -81.5 139.6 NA NA NA
ALA F:63 F:59 25.0 0.217 -80.5 139.3 NA NA NA
6yr8 1 P01116 92.77 6e-106 X-RAY
2020-07-08 ALA A:62 A:59 21.0 0.183 -130.1 -40.4 21.0 0.183 0.0 GDP
MG
HOH
6.415
5.084
2.626
CA
CB
O
O3B
MG
O
5mla 1 P01116 92.17 6e-106 X-RAY
2017-12-20 ALA A:62 A:59 7.0 0.061 -82.1 122.6 7.0 0.061 0.0 MG
GSP
HOH
6.235
3.821
2.688
CA
C
O
MG
O3G
O
5mlb 1 P01116 92.17 6e-106 X-RAY
2017-12-20 ALA A:62 A:59 3.0 0.026 -143.7 -179.1 3.0 0.026 0.0 GDP
MG
HOH
5.988
4.308
3.462
CB
CB
CB
O2B
MG
O
ALA C:62 C:59 5.0 0.043 -145.1 -177.4 NA NA NA
ALA E:62 E:59 3.0 0.026 -143.3 -179.1 NA NA NA
ALA G:62 G:59 9.0 0.078 -144.3 -177.7 NA NA NA
5o2s 1 P01116 92.17 6e-106 X-RAY
2017-07-26 ALA A:62 A:59 3.0 0.026 -143.7 -179.1 3.0 0.026 0.0 GDP
MG
HOH
5.988
4.308
3.462
CB
CB
CB
O2B
MG
O
ALA C:62 C:59 5.0 0.043 -145.1 -177.4 NA NA NA
ALA E:62 E:59 3.0 0.026 -143.3 -179.1 NA NA NA
ALA G:62 G:59 9.0 0.078 -144.3 -177.7 NA NA NA
5o2t 1 P01116 92.17 6e-106 X-RAY
2017-07-26 ALA A:62 A:59 7.0 0.061 -82.1 122.6 7.0 0.061 0.0 MG
GSP
HOH
6.235
3.821
2.688
CA
C
O
MG
O3G
O
6h46 1 P01116 92.17 6e-106 X-RAY
2019-04-24 ALA A:62 A:59 38.0 0.33 T -55.1 124.4 38.0 0.33 0.0 GDP
HOH
3.459
2.812
CB
O
O3B
O
6h47 1 P01116 92.17 6e-106 X-RAY
2019-04-24 ALA A:62 A:59 39.0 0.339 T -53.8 126.1 39.0 0.339 0.0 SO4
HOH
3.731
3.251
CB
CB
O4
O
5ufe 1 P01116 92.77 6e-106 X-RAY
2017-08-02 ALA A:59 A:59 14.0 0.122 -71.9 145.8 14.0 0.122 0.0 GNP
CD
CD
MG
HOH
4.565
5.151
7.477
5.860
3.135
C
CB
C
CA
N
O1G
CD
CD
MG
O
5uk9 1 P01116 92.77 6e-106 X-RAY
2018-01-10 ALA A:59 A:59 16.0 0.139 -146.4 128.1 16.0 0.139 0.0 GDP
MG
GOL
HOH
6.229
4.639
8.597
3.270
CB
CB
CB
O
O1B
MG
O2
O
ALA B:59 B:59 66.0 0.574 -90.8 143.6 NA NA NA
5wlb 1 P01116 92.17 6e-106 X-RAY
2018-01-03 ALA A:59 A:59 41.0 0.357 -96.0 143.8 13.0 0.113 0.244 B:None:0.243
GNP
MG
HOH
4.170
5.864
2.982
C
CA
O
O1G
MG
O
ALA D:59 D:59 42.0 0.365 -96.5 141.3 NA NA NA
5wpm 1 P01116 92.17 6e-106 X-RAY
2018-01-03 ALA A:59 A:59 43.0 0.374 -91.8 141.8 12.0 0.104 0.27 B:None:0.27
GNP
MG
MG
HOH
3.948
5.801
9.653
2.984
C
CA
O
O
O1G
MG
MG
O
6pts 2 P01116 92.22 6e-106 NMR
2020-05-13 ALA C:59 B:59 6.0 0.052 -100.2 110.0 6.0 0.052 0.0 GNP
MG
4.867
7.227
CA
CA
O3G
MG
6ptw 2 P01116 92.22 6e-106 NMR
2020-05-13 ALA C:59 B:59 8.0 0.07 -94.8 115.3 8.0 0.07 0.0 GNP
MG
4.763
6.938
C
CA
O1G
MG
6goe 1 P01116 91.07 6e-106 X-RAY
2019-02-06 ALA A:60 A:59 28.0 0.243 -77.6 144.8 28.0 0.243 0.0 MG
GNP
HOH
5.921
4.055
3.017
CA
C
O
MG
O2G
O
6bp1 1 P01116 91.12 7e-106 X-RAY
2018-01-24 GLY A:59 A:59 19.0 0.253 -91.2 159.0 19.0 0.253 0.0 GCP
HOH
3.232
1.834
HA2
H
HOG2
O
6xgu 1 P01116 91.12 7e-106 X-RAY
2021-01-13 ALA A:60 A:59 9.0 0.078 -85.9 125.8 9.0 0.078 0.0 GNP
MG
HOH
4.151
6.003
4.681
C
CA
N
O1G
MG
O
7lc2 1 P01116 91.12 7e-106 X-RAY
2021-07-28 ALA A:60 A:59 6.0 0.052 -94.9 130.1 6.0 0.052 0.0 GNP
MG
HOH
3.888
5.858
4.517
C
CA
CA
O1G
MG
O
ALA B:60 B:59 1.0 0.009 -97.1 128.8 NA NA NA
6p0z 1 P01116 91.67 7e-106 X-RAY
2019-07-31 ALA A:58 A:59 36.0 0.313 -137.0 8.3 36.0 0.313 0.0 MG
GDP
HOH
4.641
5.818
2.729
HB2
HA
O
MG
O1B
O
ALA B:58 B:59 35.0 0.304 -135.4 13.1 NA NA NA
6gog 1 P01116 91.12 8e-106 X-RAY
2019-02-06 ALA A:63 A:59 6.0 0.052 -80.4 134.3 6.0 0.052 0.0 GNP
MG
HOH
3.959
6.093
2.881
C
CA
O
O3G
MG
O
ALA B:63 B:59 17.0 0.148 -76.1 140.6 17.0 0.148 0.0 GNP
MG
HOH
3.923
5.803
2.907
C
CA
O
O3G
MG
O
ALA C:63 C:59 10.0 0.087 -76.6 140.6 10.0 0.087 0.0 GNP
MG
HOH
3.797
5.878
3.026
C
CA
O
O2G
MG
O
ALA D:63 D:59 28.0 0.243 -76.9 139.6 28.0 0.243 0.0 GNP
MG
HOH
3.943
5.885
3.019
C
CA
N
O1G
MG
O
ALA E:63 E:59 12.0 0.104 -78.2 138.1 12.0 0.104 0.0 GNP
MG
HOH
3.935
5.884
2.830
C
CA
N
O2G
MG
O
ALA F:63 F:59 10.0 0.087 -78.1 141.2 10.0 0.087 0.0 GNP
MG
HOH
3.820
5.842
2.979
C
CA
O
O2G
MG
O
6asa 1 P01116 91.62 9e-106 X-RAY
2018-01-24 ALA A:59 A:59 14.0 0.122 -72.0 153.7 14.0 0.122 0.0 GDP
MG
HOH
6.601
5.842
4.924
CA
CA
CA
O3B
MG
O
3gft 1 P01116 91.12 9e-106 X-RAY
2009-03-10 ALA A:77 A:59 7.0 0.061 -80.9 131.4 7.0 0.061 0.0 MG
GNP
UNX
HOH
6.111
3.831
3.375
2.833
CA
C
N
O
MG
O1G
UNK
O
ALA B:77 B:59 48.0 0.417 -70.1 140.8 NA NA NA
ALA C:77 C:59 59.0 0.513 -78.9 139.5 NA NA NA
ALA D:77 D:59 101.0 0.878 -92.3 144.2 NA NA NA
ALA E:77 E:59 52.0 0.452 -76.6 132.7 NA NA NA
ALA F:77 F:59 117.0 1.0 -86.5 360.0 NA NA NA
5oco 1 P01116 91.12 9e-106 X-RAY
2018-08-22 ALA A:77 B:59 11.0 0.096 -78.6 140.3 11.0 0.096 0.0 GNP
9RK
MG
HOH
3.939
9.646
5.862
3.000
C