SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2whk'

List of Similar Pattern of Amino Acids

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID		 Hit
Macromolecule		 Res.
Matches		 Interface HETATM RMSD Dali
Z-score		 Seq.
Identity (%)		 View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1E7A_A_PFLA4001_1
(SERUM ALBUMIN)		 2whk MANNAN
ENDO-1,4-BETA-MANNOS
IDASE
(Bacillus
subtilis) 		5 / 9 ILE A 249
LEU A 313
VAL A 267
GLY A 268
ALA A 241
 None
 1.30A 1e7aA-2whkA:
undetectable		 1e7aA-2whkA:
19.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1RMT_A_ADNA1501_1
(CLASS B ACID
PHOSPHATASE)		 2whk MANNAN
ENDO-1,4-BETA-MANNOS
IDASE
(Bacillus
subtilis) 		5 / 10 ASP A 240
TYR A 191
THR A 265
GLY A 238
ARG A 163
 None
None
None
None
TRS  A1338 ( 4.7A)
 1.44A 1rmtA-2whkA:
1.5		 1rmtA-2whkA:
19.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1V55_J_CHDJ3060_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE I
CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART)		 2whk MANNAN
ENDO-1,4-BETA-MANNOS
IDASE
(Bacillus
subtilis) 		4 / 7 ILE A 102
MET A 202
THR A 203
LEU A 208
 None
 0.91A 1v55A-2whkA:
undetectable
1v55J-2whkA:
undetectable		 1v55A-2whkA:
21.47
1v55J-2whkA:
11.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EIN_W_CHDW1060_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART
CYTOCHROME C OXIDASE
SUBUNIT 1)		 2whk MANNAN
ENDO-1,4-BETA-MANNOS
IDASE
(Bacillus
subtilis) 		4 / 6 ILE A 102
MET A 202
THR A 203
LEU A 208
 None
 0.95A 2einN-2whkA:
undetectable
2einW-2whkA:
undetectable		 2einN-2whkA:
21.47
2einW-2whkA:
11.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2PH9_A_GNTA301_1
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 2whk MANNAN
ENDO-1,4-BETA-MANNOS
IDASE
(Bacillus
subtilis) 		4 / 7 TYR A 125
TRP A 174
GLN A 193
TYR A 191
 None
 1.35A 2ph9A-2whkA:
undetectable
2ph9B-2whkA:
undetectable		 2ph9A-2whkA:
21.28
2ph9B-2whkA:
21.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2W13_A_ACTA1208_0
(ZINC
METALLOPROTEINASE
BAP1)		 2whk MANNAN
ENDO-1,4-BETA-MANNOS
IDASE
(Bacillus
subtilis) 		4 / 4 THR A  28
ARG A  27
GLU A  29
ASN A  30
 None
None
None
CA  A1339 (-3.1A)
 1.08A 2w13A-2whkA:
0.0		 2w13A-2whkA:
19.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3A50_A_VD3A2001_1
(VITAMIN D
HYDROXYLASE)		 2whk MANNAN
ENDO-1,4-BETA-MANNOS
IDASE
(Bacillus
subtilis) 		5 / 12 PRO A 159
ILE A  63
ILE A 236
ALA A 263
THR A 292
 None
 1.13A 3a50A-2whkA:
undetectable		 3a50A-2whkA:
24.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3A50_D_VD3D2001_1
(VITAMIN D
HYDROXYLASE)		 2whk MANNAN
ENDO-1,4-BETA-MANNOS
IDASE
(Bacillus
subtilis) 		5 / 12 PRO A 159
ILE A  63
ILE A 236
ALA A 263
THR A 292
 None
 1.13A 3a50D-2whkA:
undetectable		 3a50D-2whkA:
24.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AG3_J_CHDJ60_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 1)		 2whk MANNAN
ENDO-1,4-BETA-MANNOS
IDASE
(Bacillus
subtilis) 		4 / 7 ILE A 102
MET A 202
THR A 203
LEU A 208
 None
 0.95A 3ag3A-2whkA:
undetectable
3ag3J-2whkA:
undetectable		 3ag3A-2whkA:
21.47
3ag3J-2whkA:
11.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IK6_B_HCZB800_1
(GLUTAMATE RECEPTOR 2)		 2whk MANNAN
ENDO-1,4-BETA-MANNOS
IDASE
(Bacillus
subtilis) 		5 / 10 LEU A  33
SER A  34
ILE A 325
SER A  60
GLY A 323
 None
 1.46A 3ik6B-2whkA:
undetectable
3ik6E-2whkA:
undetectable		 3ik6B-2whkA:
22.51
3ik6E-2whkA:
22.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NVC_A_SALA370_1
(GENTISATE
1,2-DIOXYGENASE)		 2whk MANNAN
ENDO-1,4-BETA-MANNOS
IDASE
(Bacillus
subtilis) 		4 / 6 GLN A 101
HIS A 105
ARG A 163
HIS A 166
 None
TRS  A1338 (-3.9A)
TRS  A1338 ( 4.7A)
TRS  A1338 (-3.7A)
 1.24A 3nvcA-2whkA:
undetectable		 3nvcA-2whkA:
23.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3T3S_F_9PLF1_1
(CYTOCHROME P450 2A13)		 2whk MANNAN
ENDO-1,4-BETA-MANNOS
IDASE
(Bacillus
subtilis) 		4 / 8 PHE A 276
PHE A 295
PHE A 281
THR A 319
 None
 0.98A 3t3sF-2whkA:
undetectable		 3t3sF-2whkA:
22.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3WG7_W_CHDW101_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 2whk MANNAN
ENDO-1,4-BETA-MANNOS
IDASE
(Bacillus
subtilis) 		4 / 6 ILE A 102
MET A 202
THR A 203
LEU A 208
 None
 0.93A 3wg7N-2whkA:
undetectable
3wg7W-2whkA:
undetectable		 3wg7N-2whkA:
21.47
3wg7W-2whkA:
11.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FEU_D_KAND301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2whk MANNAN
ENDO-1,4-BETA-MANNOS
IDASE
(Bacillus
subtilis) 		4 / 8 ASP A  43
GLU A 266
ASP A 300
GLU A 301
 None
TRS  A1338 (-2.7A)
None
None
 1.09A 4feuD-2whkA:
undetectable		 4feuD-2whkA:
23.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QWP_A_GCSA301_1
(CHITOSANASE)		 2whk MANNAN
ENDO-1,4-BETA-MANNOS
IDASE
(Bacillus
subtilis) 		3 / 3 TYR A 278
GLY A 268
PRO A 269
 None
 0.57A 4qwpA-2whkA:
undetectable		 4qwpA-2whkA:
21.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4XJ7_A_ADNA303_1
(5'/3'-NUCLEOTIDASE
SURE)		 2whk MANNAN
ENDO-1,4-BETA-MANNOS
IDASE
(Bacillus
subtilis) 		5 / 10 GLY A 268
ASN A 307
ALA A 284
ILE A 249
TYR A 289
 None
 0.90A 4xj7A-2whkA:
undetectable
4xj7B-2whkA:
undetectable		 4xj7A-2whkA:
21.73
4xj7B-2whkA:
21.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ZDZ_A_TPFA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 2whk MANNAN
ENDO-1,4-BETA-MANNOS
IDASE
(Bacillus
subtilis) 		5 / 7 PHE A 243
ILE A 249
PHE A 276
GLY A 268
LEU A 313
 None
 1.42A 4zdzA-2whkA:
undetectable		 4zdzA-2whkA:
19.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ZE3_A_TPFA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 2whk MANNAN
ENDO-1,4-BETA-MANNOS
IDASE
(Bacillus
subtilis) 		5 / 7 PHE A 243
ILE A 249
PHE A 276
GLY A 268
LEU A 313
 None
 1.38A 4ze3A-2whkA:
undetectable		 4ze3A-2whkA:
19.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ESJ_A_TPFA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 2whk MANNAN
ENDO-1,4-BETA-MANNOS
IDASE
(Bacillus
subtilis) 		5 / 8 PHE A 243
ILE A 249
PHE A 276
GLY A 268
LEU A 313
 None
 1.39A 5esjA-2whkA:
undetectable		 5esjA-2whkA:
20.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5NUK_A_Z80A201_1
(BETA-LACTOGLOBULIN)		 2whk MANNAN
ENDO-1,4-BETA-MANNOS
IDASE
(Bacillus
subtilis) 		5 / 10 ALA A 297
VAL A 267
ILE A 285
ILE A 282
ALA A 304
 None
 1.18A 5nukA-2whkA:
undetectable		 5nukA-2whkA:
14.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XDX_J_CHDJ101_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT VIIA-HEART)		 2whk MANNAN
ENDO-1,4-BETA-MANNOS
IDASE
(Bacillus
subtilis) 		4 / 7 ILE A 102
MET A 202
THR A 203
LEU A 208
 None
 0.98A 5xdxA-2whkA:
undetectable
5xdxJ-2whkA:
undetectable		 5xdxA-2whkA:
21.47
5xdxJ-2whkA:
11.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5Z86_W_CHDW101_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 2whk MANNAN
ENDO-1,4-BETA-MANNOS
IDASE
(Bacillus
subtilis) 		4 / 6 ILE A 102
MET A 202
THR A 203
LEU A 208
 None
 0.97A 5z86N-2whkA:
undetectable
5z86W-2whkA:
undetectable		 5z86N-2whkA:
21.47
5z86W-2whkA:
11.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZCO_W_CHDW101_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 2whk MANNAN
ENDO-1,4-BETA-MANNOS
IDASE
(Bacillus
subtilis) 		4 / 6 ILE A 102
MET A 202
THR A 203
LEU A 208
 None
 0.97A 5zcoN-2whkA:
undetectable
5zcoW-2whkA:
undetectable		 5zcoN-2whkA:
21.47
5zcoW-2whkA:
11.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZCQ_J_CHDJ101_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 2whk MANNAN
ENDO-1,4-BETA-MANNOS
IDASE
(Bacillus
subtilis) 		4 / 7 ILE A 102
MET A 202
THR A 203
LEU A 208
 None
 0.97A 5zcqA-2whkA:
undetectable
5zcqJ-2whkA:
undetectable		 5zcqA-2whkA:
21.47
5zcqJ-2whkA:
11.01