SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3wqu'

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.
1RS7_B_ACTB861_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 3wqu CELL DIVISION
PROTEIN FTSA
(Staphylococcus
aureus) 		4 / 6 GLY A  27
ILE A  28
GLN A 351
SER A 367
 None
 1.00A 1rs7B-3wquA:
undetectable		 1rs7B-3wquA:
21.91
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.
1V8B_C_ADNC2502_2
(ADENOSYLHOMOCYSTEINA
SE)		 3wqu CELL DIVISION
PROTEIN FTSA
(Staphylococcus
aureus) 		3 / 3 GLU A  84
THR A  83
LEU A 222
 None
 0.66A 1v8bC-3wquA:
undetectable		 1v8bC-3wquA:
22.88
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.
2NYR_B_SVRB401_1
(NAD-DEPENDENT
DEACETYLASE
SIRTUIN-5)		 3wqu CELL DIVISION
PROTEIN FTSA
(Staphylococcus
aureus) 		5 / 12 ALA A 362
THR A 365
ALA A 215
TYR A 217
ILE A 192
 None
 1.15A 2nyrA-3wquA:
undetectable		 2nyrA-3wquA:
17.58
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.
2OA1_B_ADNB2005_1
(TRYPTOPHAN
HALOGENASE)		 3wqu CELL DIVISION
PROTEIN FTSA
(Staphylococcus
aureus) 		4 / 7 GLY A 201
GLY A 318
VAL A 223
LEU A 313
 None
 0.78A 2oa1B-3wquA:
undetectable		 2oa1B-3wquA:
21.69
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.
2Q83_A_ADNA1_1
(YTAA PROTEIN)		 3wqu CELL DIVISION
PROTEIN FTSA
(Staphylococcus
aureus) 		4 / 7 ILE A 112
PRO A 142
LEU A 375
ILE A 105
 None
 0.84A 2q83A-3wquA:
undetectable		 2q83A-3wquA:
21.33
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.
2Q83_B_ADNB2_1
(YTAA PROTEIN)		 3wqu CELL DIVISION
PROTEIN FTSA
(Staphylococcus
aureus) 		4 / 6 ILE A 112
PRO A 142
LEU A 375
ILE A 105
 None
 0.82A 2q83B-3wquA:
undetectable		 2q83B-3wquA:
21.33
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.
2VN0_A_TDZA501_1
(CYTOCHROME P450 2C8)		 3wqu CELL DIVISION
PROTEIN FTSA
(Staphylococcus
aureus) 		5 / 12 ILE A 205
LEU A 336
VAL A 304
VAL A 297
GLU A 294
 None
 1.22A 2vn0A-3wquA:
undetectable		 2vn0A-3wquA:
23.15
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.
3BRF_A_SORA2_0
(LIN-12 AND GLP-1
PHENOTYPE PROTEIN 1,
ISOFORM A)		 3wqu CELL DIVISION
PROTEIN FTSA
(Staphylococcus
aureus) 		3 / 3 LYS A 333
LYS A 343
VAL A 344
 None
 0.90A 3brfA-3wquA:
undetectable		 3brfA-3wquA:
21.79
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.
3HS6_A_EPAA1_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3wqu CELL DIVISION
PROTEIN FTSA
(Staphylococcus
aureus) 		5 / 12 SER A 326
VAL A 332
GLY A 331
ALA A 260
LEU A 289
 ATP  A 501 (-3.7A)
None
None
None
None
 0.96A 3hs6A-3wquA:
undetectable		 3hs6A-3wquA:
21.95
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.
3SUF_B_SUEB1201_1
(NS3 PROTEASE, NS4A
PROTEIN)		 3wqu CELL DIVISION
PROTEIN FTSA
(Staphylococcus
aureus) 		5 / 12 VAL A 211
GLY A  44
ILE A 158
GLY A  82
ALA A 186
 ATP  A 501 (-4.1A)
ATP  A 501 ( 3.9A)
None
None
None
 0.98A 3sufB-3wquA:
undetectable		 3sufB-3wquA:
18.34
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.
4ACA_B_DXCB1473_0
(TRANSLATION
ELONGATION FACTOR
SELB)		 3wqu CELL DIVISION
PROTEIN FTSA
(Staphylococcus
aureus) 		5 / 9 ILE A 354
GLY A 353
THR A  33
GLN A  35
GLY A  34
 None
 1.15A 4acaB-3wquA:
undetectable
4acaC-3wquA:
undetectable		 4acaB-3wquA:
24.41
4acaC-3wquA:
24.41
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.
4II8_A_010A210_0
(LYSOZYME C)		 3wqu CELL DIVISION
PROTEIN FTSA
(Staphylococcus
aureus) 		4 / 7 ASP A 185
GLN A 213
ASN A 188
ILE A 192
 None
 0.91A 4ii8A-3wquA:
undetectable		 4ii8A-3wquA:
11.53
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.
4KCN_A_ACTA803_0
(NITRIC OXIDE
SYNTHASE, BRAIN)		 3wqu CELL DIVISION
PROTEIN FTSA
(Staphylococcus
aureus) 		4 / 6 GLY A  27
ILE A  28
GLN A 351
SER A 367
 None
 1.01A 4kcnA-3wquA:
undetectable		 4kcnA-3wquA:
23.02
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.
5AQF_A_ADNA1382_1
(HEAT SHOCK COGNATE
71 KDA PROTEIN)		 3wqu CELL DIVISION
PROTEIN FTSA
(Staphylococcus
aureus) 		5 / 10 GLY A 232
GLU A 251
LYS A 254
GLY A 325
SER A 326
 ATP  A 501 (-3.5A)
ATP  A 501 (-2.6A)
ATP  A 501 (-2.8A)
ATP  A 501 (-2.9A)
ATP  A 501 (-3.7A)
 0.83A 5aqfA-3wquA:
20.3		 5aqfA-3wquA:
23.59
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.
5AQF_C_ADNC1382_1
(HEAT SHOCK COGNATE
71 KDA PROTEIN)		 3wqu CELL DIVISION
PROTEIN FTSA
(Staphylococcus
aureus) 		5 / 10 GLY A 232
GLU A 251
LYS A 254
GLY A 325
SER A 326
 ATP  A 501 (-3.5A)
ATP  A 501 (-2.6A)
ATP  A 501 (-2.8A)
ATP  A 501 (-2.9A)
ATP  A 501 (-3.7A)
 0.84A 5aqfC-3wquA:
20.2		 5aqfC-3wquA:
23.59
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.
5AQY_A_ADNA1389_1
(HEAT SHOCK 70 KDA
PROTEIN 1A)		 3wqu CELL DIVISION
PROTEIN FTSA
(Staphylococcus
aureus) 		5 / 10 GLY A 232
GLU A 251
LYS A 254
GLY A 325
SER A 326
 ATP  A 501 (-3.5A)
ATP  A 501 (-2.6A)
ATP  A 501 (-2.8A)
ATP  A 501 (-2.9A)
ATP  A 501 (-3.7A)
 0.82A 5aqyA-3wquA:
21.1		 5aqyA-3wquA:
23.56
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.
5LG3_F_Z80F401_1
(GAMMA-AMINOBUTYRIC-A
CID RECEPTOR SUBUNIT
BETA-1)		 3wqu CELL DIVISION
PROTEIN FTSA
(Staphylococcus
aureus) 		5 / 10 ILE A  56
VAL A  16
THR A  38
ASP A  48
ILE A  41
 None
 1.32A 5lg3F-3wquA:
undetectable		 5lg3F-3wquA:
20.74
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.
5LG3_G_Z80G401_1
(GAMMA-AMINOBUTYRIC-A
CID RECEPTOR SUBUNIT
BETA-1)		 3wqu CELL DIVISION
PROTEIN FTSA
(Staphylococcus
aureus) 		5 / 10 ILE A  56
VAL A  16
THR A  38
ASP A  48
ILE A  41
 None
 1.27A 5lg3G-3wquA:
undetectable		 5lg3G-3wquA:
20.74
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.
5M50_E_TA1E502_1
(TUBULIN BETA-2B
CHAIN)		 3wqu CELL DIVISION
PROTEIN FTSA
(Staphylococcus
aureus) 		5 / 12 VAL A 211
ASP A 210
GLU A 229
LEU A  76
SER A 227
 ATP  A 501 (-4.1A)
None
None
None
None
 1.06A 5m50E-3wquA:
undetectable		 5m50E-3wquA:
22.04
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.
5M5C_B_TA1B502_1
(TUBULIN BETA-2B
CHAIN)		 3wqu CELL DIVISION
PROTEIN FTSA
(Staphylococcus
aureus) 		5 / 12 VAL A 211
ASP A 210
GLU A 229
LEU A  78
SER A 227
 ATP  A 501 (-4.1A)
None
None
None
None
 1.10A 5m5cB-3wquA:
undetectable		 5m5cB-3wquA:
22.62
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.
5M5C_E_TA1E502_1
(TUBULIN BETA-2B
CHAIN)		 3wqu CELL DIVISION
PROTEIN FTSA
(Staphylococcus
aureus) 		5 / 10 VAL A 211
ASP A 210
GLU A 229
LEU A  78
SER A 227
 ATP  A 501 (-4.1A)
None
None
None
None
 1.09A 5m5cE-3wquA:
undetectable		 5m5cE-3wquA:
22.62
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.
5Q1S_A_AWYA1103_0
(DNA CROSS-LINK
REPAIR 1A PROTEIN)		 3wqu CELL DIVISION
PROTEIN FTSA
(Staphylococcus
aureus) 		4 / 6 VAL A 204
ILE A 192
LYS A 198
TYR A 217
 None
 1.48A 5q1sA-3wquA:
undetectable		 5q1sA-3wquA:
20.04
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.
5X7F_A_SAMA301_0
(PUTATIVE
O-METHYLTRANSFERASE
RV1220C)		 3wqu CELL DIVISION
PROTEIN FTSA
(Staphylococcus
aureus) 		5 / 12 GLY A 232
GLY A 324
GLY A 208
ILE A 205
ALA A 327
 ATP  A 501 (-3.5A)
ATP  A 501 ( 3.8A)
ATP  A 501 (-3.4A)
None
None
 1.06A 5x7fA-3wquA:
undetectable		 5x7fA-3wquA:
20.76
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.
6AG0_C_ACRC606_0
(ALPHA-AMYLASE)		 3wqu CELL DIVISION
PROTEIN FTSA
(Staphylococcus
aureus) 		4 / 6 GLY A 208
THR A 212
GLN A 213
TYR A 189
 ATP  A 501 (-3.4A)
None
None
None
 1.27A 6ag0C-3wquA:
undetectable		 6ag0C-3wquA:
10.62