SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1x1q'

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.
1D4S_A_TPVA201_1
(PROTEIN (HIV-1
PROTEASE))		 1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN
(Thermus
thermophilus) 		5 / 10 LEU A 173
ALA A 142
VAL A 178
GLY A 135
PHE A 169
 None
 0.96A 1d4sA-1x1qA:
undetectable		 1d4sA-1x1qA:
14.49
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.
2C12_B_SPMB1433_1
(NITROALKANE OXIDASE)		 1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN
(Thermus
thermophilus) 		5 / 11 VAL A 154
ALA A 130
SER A 140
VAL A 139
MET A 171
 None
 1.46A 2c12B-1x1qA:
0.0		 2c12B-1x1qA:
23.09
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.
2OAX_D_SNLD4001_2
(MINERALOCORTICOID
RECEPTOR)		 1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN
(Thermus
thermophilus) 		4 / 5 LEU A  70
LEU A 118
MET A 222
THR A 105
 None
 1.29A 2oaxD-1x1qA:
0.0		 2oaxD-1x1qA:
20.47
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.
2OIQ_A_STIA1001_2
(PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE SRC)		 1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN
(Thermus
thermophilus) 		4 / 5 LEU A 311
VAL A 345
LEU A 276
ARG A 224
 None
 0.98A 2oiqA-1x1qA:
undetectable		 2oiqA-1x1qA:
21.61
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.
2YVL_A_SAMA601_0
(HYPOTHETICAL PROTEIN)		 1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN
(Thermus
thermophilus) 		5 / 12 THR A 132
ILE A 209
GLY A 138
VAL A 168
VAL A 153
 None
 1.13A 2yvlA-1x1qA:
2.6		 2yvlA-1x1qA:
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.
2YVL_B_SAMB602_0
(HYPOTHETICAL PROTEIN)		 1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN
(Thermus
thermophilus) 		5 / 12 THR A 132
ILE A 209
GLY A 138
VAL A 168
VAL A 153
 None
 1.15A 2yvlB-1x1qA:
2.4		 2yvlB-1x1qA:
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.
2YVL_C_SAMC604_0
(HYPOTHETICAL PROTEIN)		 1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN
(Thermus
thermophilus) 		5 / 12 THR A 132
ILE A 209
GLY A 138
VAL A 168
VAL A 153
 None
 1.16A 2yvlC-1x1qA:
2.3		 2yvlC-1x1qA:
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.
2YVL_D_SAMD603_0
(HYPOTHETICAL PROTEIN)		 1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN
(Thermus
thermophilus) 		5 / 12 THR A 132
ILE A 209
GLY A 138
VAL A 168
VAL A 153
 None
 1.15A 2yvlD-1x1qA:
2.1		 2yvlD-1x1qA:
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.
3EM4_A_DR7A100_2
(PROTEASE)		 1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN
(Thermus
thermophilus) 		5 / 9 ALA A 264
LEU A  23
PRO A 220
VAL A 213
ILE A 260
 None
None
None
None
CL  A1001 (-4.0A)
 1.09A 3em4B-1x1qA:
undetectable		 3em4B-1x1qA:
13.54
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.
3H5G_C_LEIC16_0
(COIL SER L16D-PEN)		 1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN
(Thermus
thermophilus) 		4 / 6 LYS A 235
GLN A 237
LEU A 239
GLU A 240
 None
 1.12A 3h5gB-1x1qA:
undetectable
3h5gC-1x1qA:
undetectable		 3h5gB-1x1qA:
5.53
3h5gC-1x1qA:
5.53
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.
3HCP_B_CHDB4_0
(FERROCHELATASE,
MITOCHONDRIAL)		 1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN
(Thermus
thermophilus) 		3 / 3 GLY A 334
PRO A 331
LEU A 303
 None
 0.63A 3hcpB-1x1qA:
2.6		 3hcpB-1x1qA:
22.07
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.
3IB2_A_IBPA3960_1
(LACTOTRANSFERRIN)		 1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN
(Thermus
thermophilus) 		4 / 4 GLY A 255
VAL A 253
GLY A 289
THR A 288
 None
CL  A1001 ( 4.8A)
None
None
 0.83A 3ib2A-1x1qA:
undetectable		 3ib2A-1x1qA:
21.34
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.
3NY4_A_SMXA310_1
(BETA-LACTAMASE)		 1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN
(Thermus
thermophilus) 		4 / 8 LEU A 210
ALA A 191
THR A 192
GLY A 255
 None
 0.92A 3ny4A-1x1qA:
undetectable		 3ny4A-1x1qA:
22.70
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.
3TM4_B_SAMB401_0
(TRNA (GUANINE
N2-)-METHYLTRANSFERA
SE TRM14)		 1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN
(Thermus
thermophilus) 		5 / 12 ALA A 378
HIS A 377
GLY A 278
ALA A 267
ASN A 258
 None
 1.28A 3tm4B-1x1qA:
undetectable		 3tm4B-1x1qA:
24.21
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.
4A97_A_ZPCA1318_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN
(Thermus
thermophilus) 		4 / 7 GLU A 336
ILE A 260
PHE A  30
VAL A  38
 None
CL  A1001 (-4.0A)
None
None
 1.10A 4a97A-1x1qA:
undetectable		 4a97A-1x1qA:
19.58
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.
4A97_D_ZPCD1318_2
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN
(Thermus
thermophilus) 		4 / 7 GLU A 336
ILE A 260
PHE A  30
VAL A  38
 None
CL  A1001 (-4.0A)
None
None
 1.09A 4a97D-1x1qA:
undetectable		 4a97D-1x1qA:
19.58
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.
4A97_I_ZPCI1318_2
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN
(Thermus
thermophilus) 		4 / 6 GLU A 336
ILE A 260
PHE A  30
VAL A  38
 None
CL  A1001 (-4.0A)
None
None
 1.06A 4a97I-1x1qA:
undetectable		 4a97I-1x1qA:
19.58
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.
4JQ1_A_NPSA401_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C2)		 1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN
(Thermus
thermophilus) 		5 / 9 VAL A 141
HIS A 137
VAL A 128
ILE A 129
LEU A 188
 None
 1.49A 4jq1A-1x1qA:
0.9		 4jq1A-1x1qA:
22.43
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.
4OK1_A_198A1001_2
(ANDROGEN RECEPTOR)		 1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN
(Thermus
thermophilus) 		4 / 8 LEU A  70
ASN A 111
LEU A  18
ILE A 260
 None
None
None
CL  A1001 (-4.0A)
 1.06A 4ok1A-1x1qA:
undetectable		 4ok1A-1x1qA:
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.
5CDN_G_EVPG2101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT
B,DNA GYRASE SUBUNIT
B)		 1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN
(Thermus
thermophilus) 		4 / 6 GLY A 403
ASP A 404
ARG A 402
GLY A 401
 None
 0.85A 5cdnA-1x1qA:
undetectable
5cdnB-1x1qA:
undetectable		 5cdnA-1x1qA:
23.80
5cdnB-1x1qA:
19.76
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.
5CDN_N_EVPN2101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT
B,DNA GYRASE SUBUNIT
B)		 1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN
(Thermus
thermophilus) 		4 / 6 GLY A 403
ASP A 404
ARG A 402
GLY A 401
 None
 0.74A 5cdnR-1x1qA:
undetectable
5cdnS-1x1qA:
undetectable		 5cdnR-1x1qA:
23.80
5cdnS-1x1qA:
19.76
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.
5HWK_A_BEZA301_0
(GLUTATHIONE-SPECIFIC
GAMMA-GLUTAMYLCYCLOT
RANSFERASE)		 1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN
(Thermus
thermophilus) 		5 / 10 GLY A 231
GLY A 261
LEU A 262
LEU A 276
TYR A 340
 None
 1.25A 5hwkA-1x1qA:
undetectable		 5hwkA-1x1qA:
22.20
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.
5HWK_B_BEZB301_0
(GLUTATHIONE-SPECIFIC
GAMMA-GLUTAMYLCYCLOT
RANSFERASE)		 1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN
(Thermus
thermophilus) 		5 / 10 GLY A 231
GLY A 261
LEU A 262
LEU A 276
TYR A 340
 None
 1.26A 5hwkB-1x1qA:
undetectable		 5hwkB-1x1qA:
22.20
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.
5IEN_A_VDYA201_1
(CDL2.2)		 1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN
(Thermus
thermophilus) 		5 / 12 TRP A  90
LEU A  86
ILE A 369
ALA A 378
LEU A 399
 None
 1.33A 5ienA-1x1qA:
undetectable		 5ienA-1x1qA:
15.31
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.
5L94_A_TESA502_1
(CYTOCHROME P450)		 1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN
(Thermus
thermophilus) 		5 / 8 VAL A 395
ILE A 250
ALA A 378
PHE A  96
VAL A  95
 None
 1.35A 5l94A-1x1qA:
undetectable		 5l94A-1x1qA:
20.97
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.
5VLM_D_CVID301_1
(REGULATORY PROTEIN
TETR)		 1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN
(Thermus
thermophilus) 		4 / 8 GLN A 136
GLY A 106
GLU A 100
ILE A 110
 None
 0.99A 5vlmD-1x1qA:
undetectable		 5vlmD-1x1qA:
19.19
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.
6NM4_A_SAMA402_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
PRDM9)		 1x1q TRYPTOPHAN SYNTHASE
BETA CHAIN
(Thermus
thermophilus) 		4 / 7 ALA A 251
LEU A 399
GLY A 231
ASN A 258
 None
 0.75A 6nm4A-1x1qA:
undetectable		 6nm4A-1x1qA:
14.83