Variant
Genome | Chromosome | Position | VCF ID | Ref | Alt | mRNA Change | mRNA Info | GRCh37 | chr22 | 19950329 | . | G | A | CCDS13770.1:NM_000754.3:c.280Gac>Aac_NP_000745.1:p.94D>N | Homo sapiens catechol-O-methyltransferase (COMT), transcript variant 1, mRNA. |
---|---|---|---|---|---|---|---|
|
|
|
|
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) | |
4pyi | 1 | P21964 | 100.0 | 3e-165 |
X-RAY |
2014-06-11 | ASP | A:44 | A:94 | 63.0 | 0.42 | H | -77.3 | -32.3 | 63.0 | 0.42 | 0.0 |
HOH |
7.182 |
C |
O |
||
4pyj | 1 | P21964 | 100.0 | 3e-165 |
X-RAY |
2014-06-11 | ASP | A:44 | A:94 | 70.0 | 0.467 | -165.0 | 154.5 | 70.0 | 0.467 | 0.0 |
HOH |
5.830 |
CB |
O |
|||
4pyk | 1 | P21964 | 100.0 | 3e-165 |
X-RAY |
2014-06-11 | ASP | A:44 | A:94 | 48.0 | 0.32 | T | 53.9 | 34.8 | 48.0 | 0.32 | 0.0 | ||||||
5lsa | 1 | P21964 | 100.0 | 3e-165 |
X-RAY |
2016-09-07 | ASP | A:44 | A:94 | 69.0 | 0.46 | H | -74.1 | -44.1 | 69.0 | 0.46 | 0.0 |
CL SAM HOH |
3.408 8.670 2.569 |
N N OD2 |
CL O O |
||
6i3c | 1 | P21964 | 99.1 | 4e-164 |
X-RAY |
2019-09-18 | ASP | A:55 | A:44 | 74.0 | 0.493 | H | -74.3 | -41.3 | 74.0 | 0.493 | 0.0 |
HOH |
2.045 |
OD1 |
O |
||
6i3d | 1 | P21964 | 99.1 | 4e-164 |
X-RAY |
2019-09-18 | ASP | A:55 | A:44 | 67.0 | 0.447 | H | -78.1 | -37.2 | 67.0 | 0.447 | 0.0 |
SFG HOH |
8.751 3.554 |
N N |
O O |
||
ASP | B:55 | B:44 | 62.0 | 0.413 | H | -75.1 | -39.6 | NA | NA | NA | |||||||||||||
4xuc | 1 | P21964 | 99.54 | 1e-161 |
X-RAY |
2015-04-15 | ASP | A:47 | A:94 | 52.0 | 0.347 | H | -73.3 | -41.4 | 52.0 | 0.347 | 0.0 |
SAM HOH |
8.636 2.967 |
N N |
O O |
||
4xud | 1 | P21964 | 99.54 | 1e-161 |
X-RAY |
2015-04-15 | ASP | A:47 | A:94 | 50.0 | 0.333 | H | -80.2 | -36.0 | 50.0 | 0.333 | 0.0 |
SAM HOH |
8.667 3.056 |
N OD1 |
O O |
||
4xue | 1 | P21964 | 100.0 | 1e-159 |
X-RAY |
2015-04-15 | ASP | A:44 | B:94 | 71.0 | 0.473 | H | -79.9 | -36.6 | 71.0 | 0.473 | 0.0 |
SAM HOH |
8.606 3.544 |
N N |
O O |
||
ASP | B:44 | A:94 | 61.0 | 0.407 | H | -78.0 | -36.6 | NA | NA | NA | |||||||||||||
3a7e | 1 | P21964 | 100.0 | 1e-159 |
X-RAY |
2010-09-15 | ASP | A:46 | A:44 | 57.0 | 0.38 | H | -74.3 | -34.3 | 57.0 | 0.38 | 0.0 |
SAM HOH |
8.825 7.344 |
N OD1 |
O O |
||
3bwm | 1 | P21964 | 100.0 | 2e-159 |
X-RAY |
2008-06-03 | ASP | A:43 | A:44 | 72.0 | 0.48 | H | -72.7 | -40.8 | 72.0 | 0.48 | 0.0 |
SAM HOH |
8.658 3.531 |
N N |
O O |
||
3bwy | 1 | Q6ICE6 | 99.53 | 5e-159 |
X-RAY |
2008-06-03 | ASP | A:43 | A:44 | 69.0 | 0.46 | H | -74.2 | -44.6 | 69.0 | 0.46 | 0.0 |
SAM HOH |
8.656 2.264 |
N OD1 |
O O |
||
3nwe | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2011-08-03 | ASP | A:44 | A:44 | 68.0 | 0.453 | H | -78.8 | -31.1 | 68.0 | 0.453 | 0.0 |
CL CL 662 HOH |
9.072 2.664 9.675 2.527 |
N H N OD1 |
CL CL HO20 O |
||
3oe4 | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2011-03-16 | ASP | A:44 | A:44 | 62.0 | 0.413 | H | -69.8 | -35.5 | 62.0 | 0.413 | 0.0 |
HOH |
2.572 |
OD1 |
O |
||
3oe5 | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2011-03-16 | ASP | A:44 | A:44 | 61.0 | 0.407 | H | -73.4 | -33.9 | 61.0 | 0.407 | 0.0 |
HOH |
2.581 |
OD1 |
O |
||
3ozr | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2011-03-16 | ASP | A:44 | A:44 | 64.0 | 0.427 | H | -76.0 | -36.6 | 64.0 | 0.427 | 0.0 |
CL HOH |
9.012 2.502 |
N OD2 |
CL O |
||
3ozs | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2011-03-16 | ASP | A:44 | A:44 | 64.0 | 0.427 | H | -76.5 | -34.1 | 64.0 | 0.427 | 0.0 |
HOH |
2.752 |
OD2 |
O |
||
3ozt | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2011-03-16 | ASP | A:44 | A:44 | 57.0 | 0.38 | H | -76.2 | -30.3 | 57.0 | 0.38 | 0.0 |
HOH |
2.634 |
OD1 |
O |
||
3r6t | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2012-02-01 | ASP | A:44 | A:87 | 64.0 | 0.427 | H | -76.0 | -34.8 | 64.0 | 0.427 | 0.0 |
CL CL HOH |
9.047 3.379 2.263 |
N N OD1 |
CL CL O |
||
3u81 | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2012-02-01 | ASP | A:44 | A:44 | 77.0 | 0.513 | H | -69.8 | -37.1 | 77.0 | 0.513 | 0.0 |
SAH HOH |
8.665 2.536 |
N OD2 |
O O |
||
4pym | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2014-06-11 | ASP | A:44 | A:87 | 77.0 | 0.513 | H | -66.9 | -39.2 | 77.0 | 0.513 | 0.0 |
SO4 HOH |
9.529 2.484 |
N HB2 |
O1 O |
||
4pyn | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2014-06-11 | ASP | A:44 | A:87 | 74.0 | 0.493 | H | -69.0 | -35.2 | 74.0 | 0.493 | 0.0 |
SAH HOH |
8.495 2.250 |
N OD2 |
OXT O |
||
4pyo | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2014-06-11 | ASP | A:44 | A:87 | 121.0 | 0.807 | H | -84.4 | -19.8 | 121.0 | 0.807 | 0.0 |
HOH |
2.852 |
OD2 |
O |
||
ASP | B:44 | B:87 | 71.0 | 0.473 | H | -73.6 | -31.7 | NA | NA | NA | |||||||||||||
4pyq | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2014-06-11 | ASP | A:44 | A:87 | 60.0 | 0.4 | I | -79.5 | -36.3 | 35.0 | 0.233 | 0.167 |
B:P22734:0.167 |
HOH |
2.348 |
O |
O |
|
ASP | B:44 | B:87 | 69.0 | 0.46 | I | -78.0 | -32.1 | 41.0 | 0.273 | 0.187 |
A:P22734:0.187 |
CL HOH |
3.828 2.448 |
OD1 O |
CL O |
||||||||
5lqj | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2016-09-28 | ASP | A:44 | A:44 | 74.0 | 0.493 | H | -112.1 | -16.8 | 74.0 | 0.493 | 0.0 |
HOH |
4.793 |
OD2 |
O |
||
ASP | B:44 | B:44 | 71.0 | 0.473 | H | -76.9 | -24.4 | NA | NA | NA | |||||||||||||
ASP | C:44 | C:44 | 78.0 | 0.52 | H | -96.9 | -17.1 | NA | NA | NA | |||||||||||||
ASP | D:44 | D:44 | 77.0 | 0.513 | H | -79.3 | -44.1 | NA | NA | NA | |||||||||||||
5lqk | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2016-08-31 | ASP | A:44 | A:44 | 71.0 | 0.473 | H | -70.1 | -43.6 | 71.0 | 0.473 | 0.0 |
CL CL HOH |
8.991 3.554 3.292 |
N N N |
CL CL O |
||
5lqn | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2016-10-05 | ASP | A:44 | A:44 | 84.0 | 0.56 | S | -77.1 | -33.7 | 84.0 | 0.56 | 0.0 |
HOH |
4.358 |
OD1 |
O |
||
5lr6 | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2016-08-31 | ASP | A:44 | A:44 | 65.0 | 0.433 | S | -89.0 | -24.2 | 65.0 | 0.433 | 0.0 |
HOH |
4.064 |
CG |
O |
||
ASP | B:44 | B:44 | 70.0 | 0.467 | S | -110.8 | -6.7 | NA | NA | NA | |||||||||||||
ASP | C:44 | C:44 | 70.0 | 0.467 | H | -72.1 | -24.5 | NA | NA | NA | |||||||||||||
ASP | D:44 | D:44 | 71.0 | 0.473 | H | -75.1 | -32.8 | NA | NA | NA | |||||||||||||
5p8w | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2016-09-07 | ASP | A:44 | A:44 | 63.0 | 0.42 | H | -71.9 | -29.6 | 63.0 | 0.42 | 0.0 |
DTT HOH |
9.003 2.894 |
N N |
O2 O |
||
ASP | B:44 | B:44 | 123.0 | 0.82 | H | -64.3 | -60.6 | 86.0 | 0.573 | 0.247 |
C:P22734:0.247 |
FMT HOH |
8.727 2.924 |
C O |
O2 O |
||||||||
ASP | C:44 | C:44 | 50.0 | 0.333 | H | -73.8 | -47.6 | 50.0 | 0.333 | 0.0 |
DTT HOH |
8.955 5.479 |
N OD2 |
O2 O |
|||||||||
5p8x | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2017-08-30 | ASP | A:44 | A:44 | 62.0 | 0.413 | H | -75.6 | -35.0 | 62.0 | 0.413 | 0.0 |
CL CL HOH |
9.094 3.427 2.661 |
N N OD1 |
CL CL O |
||
5p8y | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2017-08-30 | ASP | A:44 | A:44 | 61.0 | 0.407 | H | -72.8 | -32.8 | 61.0 | 0.407 | 0.0 |
CL CL HOH |
8.961 3.550 2.762 |
N N OD1 |
CL CL O |
||
5p8z | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2017-08-30 | ASP | A:44 | A:44 | 63.0 | 0.42 | H | -75.9 | -32.3 | 63.0 | 0.42 | 0.0 |
CL CL HOH |
9.035 3.493 2.782 |
N N OD1 |
CL CL O |
||
5p90 | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2017-08-30 | ASP | A:44 | A:44 | 62.0 | 0.413 | H | -75.3 | -35.3 | 62.0 | 0.413 | 0.0 |
CL CL HOH |
9.063 3.477 2.703 |
N N OD1 |
CL CL O |
||
5p91 | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2017-08-30 | ASP | A:44 | A:44 | 65.0 | 0.433 | H | -75.2 | -36.7 | 65.0 | 0.433 | 0.0 |
CL CL HOH |
9.033 3.469 2.613 |
N N OD2 |
CL CL O |
||
5p92 | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2017-08-30 | ASP | A:44 | A:44 | 63.0 | 0.42 | H | -74.0 | -34.4 | 63.0 | 0.42 | 0.0 |
CL CL HOH |
9.054 3.457 2.740 |
N N OD1 |
CL CL O |
||
5p93 | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2017-08-30 | ASP | A:44 | A:44 | 63.0 | 0.42 | H | -76.6 | -35.2 | 63.0 | 0.42 | 0.0 |
CL CL HOH |
9.021 3.538 2.685 |
N N OD1 |
CL CL O |
||
5p94 | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2017-08-30 | ASP | A:44 | A:44 | 65.0 | 0.433 | H | -74.5 | -35.2 | 65.0 | 0.433 | 0.0 |
CL CL HOH |
9.091 3.410 2.182 |
N N OD1 |
CL CL O |
||
5p9n | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2017-11-22 | ASP | A:44 | A:44 | 61.0 | 0.407 | H | -76.7 | -35.3 | 61.0 | 0.407 | 0.0 |
CL CL HOH |
9.120 3.412 2.598 |
N N OD1 |
CL CL O |
||
5p9o | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2017-11-22 | ASP | A:44 | A:44 | 64.0 | 0.427 | H | -78.8 | -35.9 | 64.0 | 0.427 | 0.0 |
SAH CL HOH |
8.789 3.374 2.275 |
N N OD1 |
OXT CL O |
||
5p9p | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2017-11-22 | ASP | A:44 | A:44 | 64.0 | 0.427 | H | -80.0 | -37.0 | 64.0 | 0.427 | 0.0 |
CL SAH HOH |
3.352 8.799 2.358 |
N N OD1 |
CL OXT O |
||
5p9q | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2017-11-22 | ASP | A:44 | A:44 | 62.0 | 0.413 | H | -77.8 | -35.1 | 62.0 | 0.413 | 0.0 |
CL SAH HOH |
3.338 8.811 2.682 |
N N OD2 |
CL OXT O |
||
5p9r | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2017-11-22 | ASP | A:44 | A:44 | 67.0 | 0.447 | H | -74.1 | -40.3 | 67.0 | 0.447 | 0.0 |
SAH HOH |
8.784 3.390 |
N N |
O O |
||
ASP | B:44 | B:44 | 73.0 | 0.487 | H | -75.3 | -46.1 | NA | NA | NA | |||||||||||||
5p9s | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2017-11-22 | ASP | A:44 | A:44 | 67.0 | 0.447 | H | -80.6 | -38.7 | 67.0 | 0.447 | 0.0 |
SAH HOH |
8.710 3.256 |
N N |
O O |
||
5p9t | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2017-11-22 | ASP | A:44 | A:44 | 64.0 | 0.427 | H | -79.2 | -38.6 | 64.0 | 0.427 | 0.0 |
CL SAH HOH |
3.451 8.732 2.731 |
N N OD2 |
CL OXT O |
||
5p9u | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2017-11-22 | ASP | A:44 | A:44 | 63.0 | 0.42 | H | -79.2 | -34.5 | 63.0 | 0.42 | 0.0 |
SAH HOH |
8.668 2.816 |
N OD2 |
OXT O |
||
5p9v | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2017-11-22 | ASP | A:44 | A:44 | 56.0 | 0.373 | H | -77.1 | -36.2 | 56.0 | 0.373 | 0.0 |
CL SAH HOH |
3.388 8.758 2.458 |
N N OD1 |
CL OXT O |
||
5p9x | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2017-11-22 | ASP | A:44 | A:44 | 68.0 | 0.453 | H | -72.0 | -38.0 | 68.0 | 0.453 | 0.0 |
CL CL HOH |
9.108 3.396 2.467 |
N N OD2 |
CL CL O |
||
5p9y | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2017-11-22 | ASP | A:44 | A:44 | 64.0 | 0.427 | H | -75.6 | -33.6 | 64.0 | 0.427 | 0.0 |
CL CL HOH |
9.062 3.480 2.544 |
N N OD1 |
CL CL O |
||
5p9z | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2017-11-22 | ASP | A:44 | A:44 | 63.0 | 0.42 | H | -74.0 | -36.4 | 63.0 | 0.42 | 0.0 |
CL SAH HOH |
3.489 8.823 2.747 |
N N OD1 |
CL OXT O |
||
5pa0 | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2017-11-22 | ASP | A:44 | A:44 | 59.0 | 0.393 | H | -79.2 | -35.7 | 59.0 | 0.393 | 0.0 |
SAH 7JR CL HOH |
8.777 9.694 2.709 2.112 |
N N H H |
OXT H91 CL O |
||
5pa2 | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2017-11-22 | ASP | A:44 | A:44 | 64.0 | 0.427 | H | -77.4 | -37.7 | 64.0 | 0.427 | 0.0 |
CL SAH HOH |
3.428 8.783 2.703 |
N N OD1 |
CL OXT O |
||
5pa3 | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2017-11-22 | ASP | A:44 | A:44 | 61.0 | 0.407 | H | -79.1 | -37.1 | 61.0 | 0.407 | 0.0 |
SAH CL HOH |
8.817 3.406 2.469 |
N N OD2 |
OXT CL O |
||
5pa4 | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2017-11-22 | ASP | A:44 | A:44 | 67.0 | 0.447 | H | -71.5 | -38.8 | 67.0 | 0.447 | 0.0 |
SAH HOH |
8.824 2.589 |
N OD2 |
OXT O |
||
5pa5 | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2017-11-22 | ASP | A:44 | A:44 | 62.0 | 0.413 | H | -77.8 | -35.1 | 62.0 | 0.413 | 0.0 |
CL SAH HOH |
3.338 8.811 2.682 |
N N OD2 |
CL OXT O |
||
5pa6 | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2017-11-22 | ASP | A:44 | A:44 | 65.0 | 0.433 | H | -76.2 | -35.4 | 65.0 | 0.433 | 0.0 |
SAH CL HOH |
8.772 3.483 2.859 |
N N N |
OXT CL O |
||
5pa7 | 1 | P22734 | 82.03 | 6e-135 |
X-RAY |
2017-11-22 | ASP | A:44 | A:44 | 74.0 | 0.493 | H | -72.2 | -42.8 | 74.0 | 0.493 | 0.0 |
SAH 7JX HOH |
8.737 9.982 3.915 |
N N N |
O O12 O |
||
ASP | B:44 | B:44 | 132.0 | 0.88 | H | -74.6 | -30.7 | NA | NA | NA | |||||||||||||
5k09 | 1 | P22734 | 82.03 | 7e-135 |
X-RAY |
2016-09-07 | ASP | A:43 | A:44 | 88.0 | 0.587 | H | -75.7 | -46.4 | 88.0 | 0.587 | 0.0 |
HOH |
5.346 |
N |
O |
||
ASP | B:43 | B:44 | 93.0 | 0.62 | H | -66.5 | -42.2 | NA | NA | NA | |||||||||||||
ASP | C:43 | C:44 | 78.0 | 0.52 | H | -86.7 | -25.6 | NA | NA | NA | |||||||||||||
ASP | D:43 | D:44 | 89.0 | 0.593 | H | -76.8 | -48.3 | NA | NA | NA | |||||||||||||
ASP | E:43 | E:44 | 90.0 | 0.6 | H | -66.8 | -37.7 | NA | NA | NA | |||||||||||||
ASP | F:43 | F:44 | 95.0 | 0.633 | H | -73.6 | -47.0 | NA | NA | NA | |||||||||||||
ASP | G:43 | G:44 | 79.0 | 0.527 | S | -102.8 | -32.1 | NA | NA | NA | |||||||||||||
ASP | H:43 | H:44 | 89.0 | 0.593 | S | -94.1 | -38.8 | NA | NA | NA | |||||||||||||
ASP | I:43 | I:44 | 85.0 | 0.567 | H | -83.6 | -41.1 | NA | NA | NA | |||||||||||||
ASP | J:43 | J:44 | 84.0 | 0.56 | H | -69.5 | -42.8 | NA | NA | NA | |||||||||||||
ASP | K:43 | K:44 | 90.0 | 0.6 | H | -99.9 | -38.3 | NA | NA | NA | |||||||||||||
ASP | L:43 | L:44 | 88.0 | 0.587 | H | -82.9 | -42.8 | NA | NA | NA | |||||||||||||
ASP | M:43 | M:44 | 73.0 | 0.487 | H | -91.7 | -39.8 | NA | NA | NA | |||||||||||||
ASP | N:43 | N:44 | 97.0 | 0.647 | H | -71.2 | -44.2 | NA | NA | NA | |||||||||||||
ASP | O:43 | O:44 | 90.0 | 0.6 | H | -73.9 | -37.4 | NA | NA | NA | |||||||||||||
ASP | P:43 | P:44 | 102.0 | 0.68 | H | -55.4 | -57.2 | NA | NA | NA | |||||||||||||
ASP | Q:43 | Q:44 | 84.0 | 0.56 | H | -88.3 | -33.1 | NA | NA | NA | |||||||||||||
ASP | R:43 | R:44 | 103.0 | 0.687 | H | -62.6 | -44.0 | NA | NA | NA | |||||||||||||
ASP | S:43 | S:44 | 86.0 | 0.573 | H | -80.9 | -33.6 | NA | NA | NA | |||||||||||||
ASP | T:43 | T:44 | 81.0 | 0.54 | H | -92.9 | -32.5 | NA | NA | NA | |||||||||||||
ASP | U:43 | U:44 | 96.0 | 0.64 | H | -74.6 | -45.7 | NA | NA | NA | |||||||||||||
ASP | V:43 | V:44 | 97.0 | 0.647 | H | -78.1 | -44.2 | NA | NA | NA | |||||||||||||
ASP | W:43 | W:44 | 97.0 | 0.647 | H | -75.4 | -45.3 | NA | NA | NA | |||||||||||||
ASP | X:43 | X:44 | 90.0 | 0.6 | H | -85.7 | -43.4 | NA | NA | NA | |||||||||||||
5k0b | 1 | P22734 | 81.65 | 8e-135 |
X-RAY |
2016-09-07 | ASP | A:43 | A:44 | 65.0 | 0.433 | H | -71.8 | -33.3 | 65.0 | 0.433 | 0.0 |
HOH |
3.183 |
OD1 |
O |
||
ASP | B:43 | B:44 | 64.0 | 0.427 | H | -70.3 | -36.3 | NA | NA | NA | |||||||||||||
ASP | C:43 | C:44 | 69.0 | 0.46 | H | -75.1 | -32.5 | NA | NA | NA | |||||||||||||
ASP | D:43 | D:44 | 76.0 | 0.507 | H | -71.3 | -36.1 | NA | NA | NA | |||||||||||||
ASP | E:43 | E:44 | 79.0 | 0.527 | H | -73.5 | -25.8 | NA | NA | NA | |||||||||||||
ASP | F:43 | F:44 | 60.0 | 0.4 | H | -74.8 | -30.1 | NA | NA | NA | |||||||||||||
ASP | G:43 | G:44 | 60.0 | 0.4 | H | -74.9 | -30.7 | NA | NA | NA | |||||||||||||
ASP | H:43 | H:44 | 74.0 | 0.493 | H | -72.8 | -30.6 | NA | NA | NA | |||||||||||||
4p7f | 1 | O88587 | 81.19 | 1e-134 |
X-RAY |
2014-06-11 | ASP | A:44 | A:87 | 63.0 | 0.42 | I | -79.2 | -33.9 | 63.0 | 0.42 | 0.0 |
PO4 HOH |
3.713 2.744 |
OD1 O |
O4 O |
||
5k0f | 1 | P22734 | 82.41 | 1e-134 |
X-RAY |
2016-09-07 | ASP | A:43 | A:44 | 60.0 | 0.4 | H | -69.7 | -31.5 | 60.0 | 0.4 | 0.0 |
HOH |
2.999 |
N |
O |
||
ASP | B:43 | B:44 | 65.0 | 0.433 | H | -68.0 | -35.6 | NA | NA | NA | |||||||||||||
5k0g | 1 | P22734 | 82.41 | 1e-134 |
X-RAY |
2016-09-07 | ASP | A:43 | A:44 | 63.0 | 0.42 | H | -68.4 | -33.2 | 63.0 | 0.42 | 0.0 |
HOH |
2.850 |
N |
O |
||
ASP | B:43 | B:44 | 64.0 | 0.427 | H | -67.1 | -33.9 | NA | NA | NA | |||||||||||||
5k0j | 1 | P22734 | 82.41 | 1e-134 |
X-RAY |
2016-09-07 | ASP | A:43 | A:44 | 50.0 | 0.333 | H | -74.4 | -29.4 | 50.0 | 0.333 | 0.0 |
HOH |
2.902 |
N |
O |
||
ASP | B:43 | B:44 | 62.0 | 0.413 | H | -74.2 | -28.4 | NA | NA | NA | |||||||||||||
5k0n | 1 | P22734 | 81.94 | 4e-134 |
X-RAY |
2016-09-07 | ASP | A:43 | A:44 | 68.0 | 0.453 | H | -72.1 | -31.0 | 68.0 | 0.453 | 0.0 |
HOH |
2.983 |
N |
O |
||
ASP | B:43 | B:44 | 67.0 | 0.447 | S | -79.7 | -29.8 | NA | NA | NA | |||||||||||||
ASP | C:43 | C:44 | 61.0 | 0.407 | H | -73.0 | -30.0 | NA | NA | NA | |||||||||||||
ASP | D:43 | D:44 | 54.0 | 0.36 | H | -66.8 | -32.3 | NA | NA | NA | |||||||||||||
5k0l | 1 | P22734 | 81.94 | 4e-134 |
X-RAY |
2016-09-07 | ASP | A:43 | A:44 | 67.0 | 0.447 | H | -77.9 | -30.7 | 67.0 | 0.447 | 0.0 |
HOH |
2.851 |
N |
O |
||
ASP | B:43 | B:44 | 74.0 | 0.493 | H | -80.2 | -31.2 | NA | NA | NA | |||||||||||||
ASP | C:43 | C:44 | 64.0 | 0.427 | H | -71.4 | -27.9 | NA | NA | NA | |||||||||||||
ASP | D:43 | D:44 | 56.0 | 0.373 | H | -68.2 | -35.2 | NA | NA | NA | |||||||||||||
5k0c | 1 | P22734 | 82.33 | 5e-134 |
X-RAY |
2016-09-07 | ASP | A:43 | A:44 | 61.0 | 0.407 | H | -70.8 | -31.6 | 61.0 | 0.407 | 0.0 |
HOH |
2.482 |
OD2 |
O |
||
ASP | B:43 | B:44 | 67.0 | 0.447 | H | -64.8 | -35.2 | NA | NA | NA | |||||||||||||
5k0e | 1 | P22734 | 82.33 | 5e-134 |
X-RAY |
2016-09-07 | ASP | A:43 | A:44 | 89.0 | 0.593 | H | -81.9 | -28.2 | 89.0 | 0.593 | 0.0 | ||||||
6aw5 | 1 | ? | 81.0 | 5e-134 |
X-RAY |
2018-09-12 | ASP | A:44 | A:44 | 113.0 | 0.753 | I | -82.3 | -35.1 | 113.0 | 0.753 | 0.0 |
HOH |
3.156 |
N |
O |
||
6aw6 | 1 | ? | 81.0 | 5e-134 |
X-RAY |
2018-09-12 | ASP | A:44 | A:44 | 117.0 | 0.78 | I | -77.9 | -36.2 | 117.0 | 0.78 | 0.0 |
HOH |
2.827 |
O |
O |
||
6aw9 | 1 | ? | 81.0 | 5e-134 |
X-RAY |
2018-09-12 | ASP | A:44 | A:44 | 61.0 | 0.407 | H | -73.8 | -37.7 | 61.0 | 0.407 | 0.0 |
SAH HOH |
8.954 4.086 |
N N |
O O |
||
ASP | B:44 | B:44 | 69.0 | 0.46 | H | -82.2 | -38.6 | NA | NA | NA | |||||||||||||
ASP | C:44 | C:44 | 78.0 | 0.52 | T | -86.1 | -32.4 | NA | NA | NA | |||||||||||||
6aw4 | 1 | ? | 80.54 | 2e-133 |
X-RAY |
2018-09-12 | ASP | A:44 | A:44 | 72.0 | 0.48 | I | -75.7 | -37.2 | 72.0 | 0.48 | 0.0 |
HOH |
2.769 |
O |
O |
||
6aw7 | 1 | ? | 80.54 | 2e-133 |
X-RAY |
2018-09-12 | ASP | A:44 | A:44 | 68.0 | 0.453 | H | -71.4 | -42.9 | 68.0 | 0.453 | 0.0 |
SAH HOH |
8.773 2.508 |
N OD1 |
OXT O |
||
ASP | B:44 | B:44 | 69.0 | 0.46 | H | -84.0 | -37.9 | NA | NA | NA | |||||||||||||
6aw8 | 1 | ? | 80.54 | 2e-133 |
X-RAY |
2018-09-12 | ASP | A:44 | A:44 | 72.0 | 0.48 | H | -77.7 | -38.2 | 72.0 | 0.48 | 0.0 |
SAH HOH |
8.711 2.398 |
N OD1 |
OXT O |
||
ASP | B:44 | B:44 | 63.0 | 0.42 | H | -84.0 | -33.9 | NA | NA | NA | |||||||||||||
ASP | C:44 | C:44 | 62.0 | 0.413 | H | -83.4 | -36.6 | NA | NA | NA | |||||||||||||
5k05 | 1 | P22734 | 82.24 | 2e-133 |
X-RAY |
2016-09-07 | ASP | A:42 | A:44 | 65.0 | 0.433 | H | -97.0 | -19.4 | 65.0 | 0.433 | 0.0 |
HOH |
2.644 |
OD1 |
O |
||
ASP | B:42 | B:44 | 64.0 | 0.427 | H | -62.8 | -37.7 | NA | NA | NA | |||||||||||||
1h1d | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
2003-07-17 | ASP | A:44 | A:44 | 66.0 | 0.44 | H | -79.2 | -36.5 | 66.0 | 0.44 | 0.0 |
SAM HOH |
8.736 2.934 |
N N |
O O |
||
1jr4 | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
2002-08-10 | ASP | A:44 | A:44 | 70.0 | 0.467 | H | -83.2 | -36.9 | 70.0 | 0.467 | 0.0 |
HOH |
6.737 |
O |
O |
||
1vid | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
1996-07-11 | ASP | A:44 | A:44 | 72.0 | 0.48 | H | -77.1 | -36.4 | 72.0 | 0.48 | 0.0 |
SAM HOH |
8.590 2.723 |
N N |
O O |
||
2cl5 | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
2006-06-28 | ASP | A:44 | A:44 | 60.0 | 0.4 | H | -70.4 | -36.3 | 60.0 | 0.4 | 0.0 |
SAM HOH |
8.645 2.684 |
N OD1 |
O O |
||
ASP | B:44 | B:44 | 56.0 | 0.373 | H | -73.0 | -36.8 | NA | NA | NA | |||||||||||||
3hvh | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
2009-10-13 | ASP | A:44 | A:87 | 64.0 | 0.427 | H | -73.3 | -32.4 | 64.0 | 0.427 | 0.0 |
CL HOH |
3.482 2.646 |
N OD1 |
CL O |
||
3hvi | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
2009-10-13 | ASP | A:44 | A:87 | 64.0 | 0.427 | H | -77.1 | -34.8 | 64.0 | 0.427 | 0.0 |
CL HOH |
3.345 2.164 |
N OD1 |
CL O |
||
3hvj | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
2009-10-13 | ASP | A:44 | A:87 | 81.0 | 0.54 | H | -73.7 | -42.3 | 81.0 | 0.54 | 0.0 |
CL HOH |
3.210 2.714 |
N OD2 |
CL O |
||
ASP | B:44 | B:87 | 65.0 | 0.433 | H | -70.6 | -36.7 | NA | NA | NA | |||||||||||||
3hvk | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
2009-10-13 | ASP | A:44 | A:87 | 63.0 | 0.42 | H | -76.8 | -33.8 | 63.0 | 0.42 | 0.0 |
CL CL HOH |
9.089 3.357 2.472 |
N N OD1 |
CL CL O |
||
3nw9 | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
2011-03-16 | ASP | A:44 | A:44 | 61.0 | 0.407 | H | -71.9 | -36.1 | 61.0 | 0.407 | 0.0 |
CL CL HOH |
9.039 3.391 2.453 |
N N OD2 |
CL CL O |
||
3nwb | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
2011-08-03 | ASP | A:44 | A:44 | 67.0 | 0.447 | H | -74.4 | -36.2 | 67.0 | 0.447 | 0.0 |
CL CL 659 HOH |
9.066 2.758 9.735 2.432 |
N H N OD2 |
CL CL HO22 O |
||
3s68 | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
2012-02-01 | ASP | A:44 | A:44 | 60.0 | 0.4 | H | -78.2 | -33.9 | 60.0 | 0.4 | 0.0 |
CL TCW SAM HOH |
2.620 9.608 8.774 2.544 |
H N N OD1 |
CL HO7 O O |
||
4p7g | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
2014-06-18 | ASP | A:44 | A:87 | 80.0 | 0.533 | T | -115.2 | -18.8 | 80.0 | 0.533 | 0.0 | ||||||
ASP | B:44 | B:87 | 79.0 | 0.527 | T | -123.2 | -16.9 | NA | NA | NA | |||||||||||||
ASP | C:44 | C:87 | 66.0 | 0.44 | T | -104.8 | -56.6 | NA | NA | NA | |||||||||||||
ASP | D:44 | D:87 | 79.0 | 0.527 | H | -107.1 | -22.3 | NA | NA | NA | |||||||||||||
4p7j | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
2014-06-18 | ASP | A:44 | A:87 | 85.0 | 0.567 | I | -76.8 | -39.2 | 85.0 | 0.567 | 0.0 |
HOH |
2.348 |
OD1 |
O |
||
4p7k | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
2014-06-18 | ASP | A:44 | A:87 | 75.0 | 0.5 | H | -68.2 | -32.9 | 75.0 | 0.5 | 0.0 |
SFG HOH |
8.587 2.538 |
N HB2 |
O O |
||
4pyl | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
2014-06-18 | ASP | A:44 | A:87 | 73.0 | 0.487 | H | -76.0 | -39.4 | 73.0 | 0.487 | 0.0 |
SFG TCW HOH |
8.607 9.970 3.753 |
N N N |
OXT O7 O |
||
5lqc | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
2016-08-31 | ASP | A:44 | A:44 | 73.0 | 0.487 | H | -74.9 | -34.0 | 73.0 | 0.487 | 0.0 |
HOH |
3.868 |
N |
O |
||
5lqr | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
2016-10-05 | ASP | A:44 | A:44 | 66.0 | 0.44 | H | -71.7 | -32.6 | 66.0 | 0.44 | 0.0 |
CL CL HOH |
9.032 3.433 2.297 |
N N OD1 |
CL CL O |
||
5lqu | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
2016-10-05 | ASP | A:44 | A:44 | 83.0 | 0.553 | H | -71.1 | -46.7 | 83.0 | 0.553 | 0.0 |
CL HOH |
3.236 2.708 |
N OD2 |
CL O |
||
ASP | B:44 | B:44 | 66.0 | 0.44 | H | -74.9 | -31.5 | NA | NA | NA | |||||||||||||
5p95 | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
2017-08-30 | ASP | A:44 | A:44 | 65.0 | 0.433 | H | -77.9 | -33.7 | 65.0 | 0.433 | 0.0 |
CL CL HOH |
9.105 3.422 1.965 |
N N OD1 |
CL CL O |
||
5p96 | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
2017-08-30 | ASP | A:44 | A:44 | 63.0 | 0.42 | H | -75.5 | -32.9 | 63.0 | 0.42 | 0.0 |
CL CL HOH |
9.079 3.440 2.305 |
N N OD1 |
CL CL O |
||
5p97 | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
2017-08-30 | ASP | A:44 | A:44 | 67.0 | 0.447 | H | -71.3 | -38.3 | 67.0 | 0.447 | 0.0 |
CL CL HOH |
3.366 9.075 2.416 |
N N OD1 |
CL CL O |
||
5p98 | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
2017-08-30 | ASP | A:44 | A:44 | 64.0 | 0.427 | H | -76.8 | -36.5 | 64.0 | 0.427 | 0.0 |
CL CL HOH |
9.045 3.442 2.114 |
N N OD1 |
CL CL O |
||
5p99 | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
2017-08-30 | ASP | A:44 | A:44 | 68.0 | 0.453 | H | -74.0 | -36.3 | 68.0 | 0.453 | 0.0 |
CL CL HOH |
9.121 3.423 2.243 |
N N OD1 |
CL CL O |
||
5p9a | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
2017-08-30 | ASP | A:44 | A:44 | 68.0 | 0.453 | H | -71.9 | -39.4 | 68.0 | 0.453 | 0.0 |
K HOH |
9.134 2.655 |
N OD2 |
K O |
||
5p9b | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
2017-08-30 | ASP | A:44 | A:44 | 68.0 | 0.453 | H | -72.8 | -37.1 | 68.0 | 0.453 | 0.0 |
CL CL HOH |
9.052 3.389 2.362 |
N N OD1 |
CL CL O |
||
5p9c | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
2017-08-30 | ASP | A:44 | A:44 | 63.0 | 0.42 | H | -71.0 | -37.2 | 63.0 | 0.42 | 0.0 |
K HOH |
9.069 2.724 |
N OD1 |
K O |
||
5p9d | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
2017-08-30 | ASP | A:44 | A:44 | 70.0 | 0.467 | H | -75.6 | -36.4 | 70.0 | 0.467 | 0.0 |
K HOH |
9.110 2.455 |
N OD1 |
K O |
||
5p9e | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
2017-08-30 | ASP | A:44 | A:44 | 66.0 | 0.44 | H | -76.5 | -38.0 | 66.0 | 0.44 | 0.0 |
CL CL HOH |
3.440 9.093 2.661 |
N N OD2 |
CL CL O |
||
5p9w | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
2017-11-22 | ASP | A:44 | A:44 | 64.0 | 0.427 | H | -73.3 | -34.1 | 64.0 | 0.427 | 0.0 |
CL CL HOH |
3.407 9.132 2.243 |
N N OD1 |
CL CL O |
||
5pa1 | 1 | P22734 | 81.11 | 2e-133 |
X-RAY |
2017-11-22 | ASP | A:44 | A:44 | 63.0 | 0.42 | H | -81.9 | -33.4 | 63.0 | 0.42 | 0.0 |
CL SAH HOH |
3.367 8.797 2.288 |
N N OD1 |
CL O O |
||
2zlb | 1 | P22734 | 81.11 | 3e-133 |
X-RAY |
2008-10-07 | ASP | A:46 | A:44 | 77.0 | 0.513 | H | -45.5 | -51.7 | 77.0 | 0.513 | 0.0 |
HOH |
3.324 |
OD1 |
O |
||
2zth | 1 | P22734 | 81.11 | 3e-133 |
X-RAY |
2009-01-13 | ASP | A:46 | A:44 | 73.0 | 0.487 | S | -84.6 | -9.5 | 73.0 | 0.487 | 0.0 |
SAM HOH |
9.256 3.090 |
N N |
O O |
||
2zvj | 1 | P22734 | 81.11 | 3e-133 |
X-RAY |
2009-01-06 | ASP | A:46 | A:44 | 62.0 | 0.413 | H | -75.0 | -42.4 | 62.0 | 0.413 | 0.0 |
SAM KOM HOH |
8.655 9.813 4.064 |
N N N |
O O10 O |
||
3a7d | 1 | P22734 | 81.11 | 3e-133 |
X-RAY |
2010-09-15 | ASP | A:46 | A:44 | 56.0 | 0.373 | H | -76.1 | -34.7 | 56.0 | 0.373 | 0.0 |
SO4 SO4 HOH |
8.493 3.124 4.184 |
N N N |
O1 O4 O |
||
6gy1 | 1 | P22734 | 81.11 | 3e-133 |
X-RAY |
2018-10-10 | ASP | A:46 | A:44 | 62.0 | 0.413 | H | -81.5 | -37.9 | 62.0 | 0.413 | 0.0 |
SAH HOH |
8.733 3.528 |
N N |
O O |
||
6lfe | 1 | P22734 | 81.11 | 3e-133 |
X-RAY |
2020-03-04 | ASP | A:46 | A:44 | 61.0 | 0.407 | H | -77.9 | -36.4 | 61.0 | 0.407 | 0.0 |
SAM HOH |
8.774 2.663 |
N OD2 |
OXT O |
||
5k01 | 1 | P22734 | 81.78 | 1e-132 |
X-RAY |
2016-09-07 | ASP | A:42 | A:44 | 61.0 | 0.407 | H | -70.0 | -35.0 | 61.0 | 0.407 | 0.0 |
HOH |
2.001 |
H |
O |
||
5k03 | 1 | P22734 | 81.78 | 1e-132 |
X-RAY |
2016-09-07 | ASP | A:42 | A:44 | 60.0 | 0.4 | H | -70.2 | -35.3 | 60.0 | 0.4 | 0.0 |
HOH |
2.483 |
OD2 |
O |
||
4p58 | 1 | O88587 | 81.6 | 2e-131 |
X-RAY |
2014-06-25 | ASP | A:41 | A:87 | 83.0 | 0.553 | H | -81.8 | -31.8 | 83.0 | 0.553 | 0.0 |
HOH |
2.673 |
OD2 |
O |
||
5fhq | 1 | P22734 | 81.22 | 9e-131 |
X-RAY |
2016-02-03 | ASP | A:42 | A:44 | 47.0 | 0.313 | H | -74.3 | -37.6 | 47.0 | 0.313 | 0.0 |
SAM DNC HOH |
8.561 9.374 2.863 |
N N OD1 |
OXT HO1 O |
||
5lqa | 1 | P22734 | 81.22 | 9e-131 |
X-RAY |
2016-10-05 | ASP | A:42 | A:44 | 64.0 | 0.427 | H | -73.6 | -36.0 | 64.0 | 0.427 | 0.0 |
CL CL HOH |
9.057 3.399 2.143 |
N N OD1 |
CL CL O |
||
5fhr | 1 | P22734 | 80.75 | 2e-129 |
X-RAY |
2016-02-03 | ASP | A:42 | A:87 | 64.0 | 0.427 | H | -69.7 | -39.8 | 64.0 | 0.427 | 0.0 |
DNC SAM HOH |
9.866 8.621 2.511 |
N N OD2 |
O1 OXT O |
||
ASP | B:42 | B:87 | 61.0 | 0.407 | H | -70.6 | -41.8 | 61.0 | 0.407 | 0.0 |
DNC SAM HOH |
9.861 8.585 2.578 |
N N OD1 |
O1 OXT O |
AlphaFold DB
Entity | Residue | Monomer | View | ||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
ID | Entity | Uniprot | Identity | Evalue | Name | Label | Auth | ASA | rASA | SS | φ | ψ | |
af-p21964-f1 | 1 | P21964 | 100.0 | 0.0 | ASP | A:94 | A:94 | 48.0 | 0.32 | H | -69.1 | -42.0 |