SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4qyj'

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.
1ME7_A_MOAA600_1
(INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
4 / 8 ILE A 328
GLY A 325
CYH A 368
GLY A 370
None
0.74A 1me7A-4qyjA:
undetectable
1me7A-4qyjA:
22.26
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.
1VPO_H_TESH1010_1
(ANTI-TESTOSTERONE
(HEAVY CHAIN)
ANTI-TESTOSTERONE
(LIGHT CHAIN))
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
5 / 12 SER A 272
ALA A 449
GLY A 450
LEU A 428
PHE A 466
None
1.19A 1vpoH-4qyjA:
undetectable
1vpoL-4qyjA:
undetectable
1vpoH-4qyjA:
18.92
1vpoL-4qyjA:
17.60
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.
2DQY_C_CHDC3_0
(LIVER
CARBOXYLESTERASE 1)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
4 / 6 LEU A 172
LEU A 204
PRO A 193
VAL A 220
None
1.19A 2dqyC-4qyjA:
undetectable
2dqyC-4qyjA:
24.28
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.
2J2P_C_SC2C1289_1
(FICOLIN-2)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
4 / 6 SER A 424
SER A 472
LEU A 428
GLY A 427
None
0.98A 2j2pA-4qyjA:
undetectable
2j2pC-4qyjA:
undetectable
2j2pA-4qyjA:
17.98
2j2pC-4qyjA:
17.98
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.
2J2P_E_SC2E1290_1
(FICOLIN-2)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
5 / 9 SER A 424
VAL A 425
SER A 472
LEU A 428
GLU A 400
None
1.26A 2j2pD-4qyjA:
0.0
2j2pE-4qyjA:
0.0
2j2pD-4qyjA:
17.98
2j2pE-4qyjA:
17.98
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.
2J2P_F_SC2F1289_1
(FICOLIN-2)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
4 / 6 SER A 424
SER A 472
LEU A 428
GLY A 427
None
0.97A 2j2pD-4qyjA:
undetectable
2j2pF-4qyjA:
undetectable
2j2pD-4qyjA:
17.98
2j2pF-4qyjA:
17.98
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.
2J9C_A_ACTA1121_0
(HYPOTHETICAL
NITROGEN REGULATORY
PII-LIKE PROTEIN
MJ0059)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
4 / 5 SER A 431
VAL A 452
SER A 272
VAL A 274
None
1.34A 2j9cA-4qyjA:
undetectable
2j9cB-4qyjA:
undetectable
2j9cC-4qyjA:
undetectable
2j9cA-4qyjA:
13.83
2j9cB-4qyjA:
13.83
2j9cC-4qyjA:
13.83
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.
3ERD_B_DESB800_1
(ESTROGEN RECEPTOR
ALPHA)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
5 / 10 ALA A 211
GLU A 210
LEU A  89
LEU A  88
LEU A 123
None
1.49A 3erdB-4qyjA:
undetectable
3erdB-4qyjA:
19.73
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.
3LD6_B_KKKB602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
5 / 12 PHE A 466
TRP A 177
GLY A  93
ALA A  97
THR A 101
None
1.43A 3ld6B-4qyjA:
undetectable
3ld6B-4qyjA:
21.10
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.
3NRR_A_D16A530_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
5 / 12 ALA A 242
ILE A 253
LEU A 268
GLY A 245
TYR A 426
None
1.15A 3nrrA-4qyjA:
2.1
3nrrA-4qyjA:
22.50
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.
3NRR_B_D16B530_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
5 / 12 ALA A 242
ILE A 253
LEU A 268
GLY A 245
TYR A 426
None
1.13A 3nrrB-4qyjA:
2.1
3nrrB-4qyjA:
22.50
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.
3SGL_A_SAMA692_0
(TRNA
5-METHYLAMINOMETHYL-
2-THIOURIDINE
BIOSYNTHESIS
BIFUNCTIONAL PROTEIN
MNMC)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
5 / 12 GLY A 341
GLY A 105
THR A 101
LEU A 108
GLY A 331
None
0.98A 3sglA-4qyjA:
undetectable
3sglA-4qyjA:
22.68
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.
3V3O_B_T1CB405_1
(TETX2 PROTEIN)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
5 / 12 GLN A 299
ASN A 351
HIS A 348
GLY A 403
ALA A 373
None
1.28A 3v3oB-4qyjA:
2.6
3v3oB-4qyjA:
21.93
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.
3ZQ8_B_DVAB8_0
(VAL-GRAMICIDIN A)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
3 / 3 TRP A 122
VAL A 116
TRP A 177
None
1.50A 3zq8A-4qyjA:
undetectable
3zq8B-4qyjA:
undetectable
3zq8A-4qyjA:
3.83
3zq8B-4qyjA:
3.83
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.
4A6N_B_T1CB392_1
(TETX2 PROTEIN)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
5 / 11 GLN A 299
ASN A 351
HIS A 348
GLY A 403
GLY A 378
None
1.41A 4a6nB-4qyjA:
undetectable
4a6nB-4qyjA:
24.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4FR8_A_TNGA601_1
(ALDEHYDE
DEHYDROGENASE,
MITOCHONDRIAL)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
5 / 11 ASN A 169
PHE A 170
LEU A 173
MET A 174
CYH A 301
None
0.95A 4fr8A-4qyjA:
55.7
4fr8A-4qyjA:
43.89
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4FR8_A_TNGA601_1
(ALDEHYDE
DEHYDROGENASE,
MITOCHONDRIAL)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
5 / 11 ASN A 169
PHE A 170
LEU A 173
MET A 174
TRP A 177
None
0.47A 4fr8A-4qyjA:
55.7
4fr8A-4qyjA:
43.89
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.
4OLT_B_GCSB301_1
(CHITOSANASE)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
3 / 3 GLY A 341
PRO A 342
GLN A 299
None
0.43A 4oltB-4qyjA:
undetectable
4oltB-4qyjA:
19.88
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.
4QWP_B_GCSB305_1
(CHITOSANASE)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
3 / 3 GLY A 341
PRO A 342
GLN A 299
None
0.35A 4qwpB-4qyjA:
undetectable
4qwpB-4qyjA:
19.69
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.
4WS0_A_URFA301_1
(URACIL-DNA
GLYCOSYLASE)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
4 / 7 GLY A 298
GLN A 299
TYR A 110
HIS A 297
None
1.18A 4ws0A-4qyjA:
undetectable
4ws0A-4qyjA:
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.
4Y1D_D_DVAD5_0
(CYCLIC HEXAPEPTIDE
CYC[NDPOPPKID]
INTEGRASE)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
3 / 3 GLU A 100
LYS A 106
ASN A 103
None
1.03A 4y1dA-4qyjA:
undetectable
4y1dD-4qyjA:
undetectable
4y1dA-4qyjA:
16.31
4y1dD-4qyjA:
2.60
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.
4Z53_F_TR6F101_1
(DNA TOPOISOMERASE 4
SUBUNIT B,DNA
TOPOISOMERASE 4
SUBUNIT A
E-SITE DNA)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
4 / 6 GLY A 223
ASP A  48
GLY A 225
SER A 345
None
1.03A 4z53A-4qyjA:
undetectable
4z53B-4qyjA:
undetectable
4z53A-4qyjA:
21.95
4z53B-4qyjA:
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.
5C0O_G_SAMG301_0
(TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
TRMI)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
5 / 12 GLY A 245
GLY A 269
GLY A 473
LEU A 266
GLU A 196
None
0.87A 5c0oG-4qyjA:
4.2
5c0oG-4qyjA:
19.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5FHZ_A_REAA602_1
(ALDEHYDE
DEHYDROGENASE FAMILY
1 MEMBER A3)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
5 / 12 ASN A 169
MET A 174
TRP A 177
CYH A 301
THR A 302
None
0.71A 5fhzA-4qyjA:
53.5
5fhzA-4qyjA:
42.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5FHZ_A_REAA602_1
(ALDEHYDE
DEHYDROGENASE FAMILY
1 MEMBER A3)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
6 / 12 ASN A 169
PHE A 170
LEU A 173
MET A 174
TRP A 177
CYH A 301
None
0.63A 5fhzA-4qyjA:
53.5
5fhzA-4qyjA:
42.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5FHZ_D_READ602_1
(ALDEHYDE
DEHYDROGENASE FAMILY
1 MEMBER A3)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
5 / 12 ASN A 169
MET A 174
TRP A 177
CYH A 301
THR A 302
None
0.72A 5fhzD-4qyjA:
53.8
5fhzD-4qyjA:
42.41
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.
5HWA_A_GCSA303_1
(CHITOSANASE)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
4 / 5 HIS A 235
VAL A 221
GLY A 229
ALA A 228
None
1.01A 5hwaA-4qyjA:
undetectable
5hwaA-4qyjA:
20.70
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.
5IGV_A_ZITA404_1
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
5 / 12 ILE A 356
GLY A 370
GLU A 400
ALA A 364
ILE A 293
None
1.17A 5igvA-4qyjA:
undetectable
5igvA-4qyjA:
21.63
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.
5IGY_A_ERYA403_0
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
5 / 12 ILE A 356
GLY A 369
GLU A 400
ALA A 364
ILE A 293
None
0.91A 5igyA-4qyjA:
undetectable
5igyA-4qyjA:
21.63
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.
5IH0_A_ERYA404_0
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
5 / 12 ILE A 356
GLY A 369
GLU A 400
ALA A 364
ILE A 293
None
0.94A 5ih0A-4qyjA:
undetectable
5ih0A-4qyjA:
21.63
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.
5NWW_A_ACAA18_1
(SCRFP-TAG,GP41)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
5 / 12 GLY A 331
SER A 332
ASN A 104
LEU A 102
LEU A  43
None
1.20A 5nwwA-4qyjA:
undetectable
5nwwA-4qyjA:
5.29
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.
5OS7_A_ACTA402_0
(CASEIN KINASE II
SUBUNIT ALPHA)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
3 / 3 HIS A 485
SER A 265
LYS A 240
None
1.35A 5os7A-4qyjA:
undetectable
5os7A-4qyjA:
20.64
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.
6CI6_A_NBOA607_1
(SERUM ALBUMIN)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
4 / 7 ALA A 175
LYS A 178
GLU A 477
LEU A 123
None
1.02A 6ci6A-4qyjA:
undetectable
6ci6A-4qyjA:
9.24
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.
6DH6_A_017A104_0
(PROTEASE)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
5 / 12 GLY A 269
ASP A 471
VAL A 474
GLY A 250
VAL A 249
None
1.00A 6dh6A-4qyjA:
undetectable
6dh6A-4qyjA:
10.27
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.
6GIQ_T_PCFT101_0
(CYTOCHROME B-C1
COMPLEX SUBUNIT 1,
MITOCHONDRIAL
CYTOCHROME B-C1
COMPLEX SUBUNIT 9
CYTOCHROME B-C1
COMPLEX SUBUNIT
RIESKE,
MITOCHONDRIAL)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
4 / 8 GLY A 270
SER A 272
ASN A 169
VAL A 300
None
1.01A 6giqL-4qyjA:
undetectable
6giqP-4qyjA:
undetectable
6giqT-4qyjA:
undetectable
6giqL-4qyjA:
22.73
6giqP-4qyjA:
19.19
6giqT-4qyjA:
8.58
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.
6GMD_B_ACTB402_0
(CASEIN KINASE II
SUBUNIT ALPHA)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
3 / 3 HIS A 485
SER A 265
LYS A 240
None
1.35A 6gmdB-4qyjA:
undetectable
6gmdB-4qyjA:
20.64
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.
6GSD_A_STRA401_0
(PROGESTERONE
5-BETA-REDUCTASE)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
5 / 12 VAL A 452
ILE A 432
ASN A 422
VAL A 418
ILE A 275
None
1.39A 6gsdA-4qyjA:
3.2
6gsdA-4qyjA:
10.08
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.
6HU9_I_PCFI101_0
(CYTOCHROME B-C1
COMPLEX SUBUNIT 1,
MITOCHONDRIAL
CYTOCHROME B-C1
COMPLEX SUBUNIT 9
CYTOCHROME B-C1
COMPLEX SUBUNIT
RIESKE,
MITOCHONDRIAL)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
5 / 11 GLY A 270
SER A 272
ALA A 430
ASN A 169
VAL A 300
None
1.30A 6hu9A-4qyjA:
1.5
6hu9E-4qyjA:
undetectable
6hu9I-4qyjA:
undetectable
6hu9A-4qyjA:
23.13
6hu9E-4qyjA:
17.25
6hu9I-4qyjA:
8.58
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.
6HU9_T_PCFT101_0
(CYTOCHROME B-C1
COMPLEX SUBUNIT 1,
MITOCHONDRIAL
CYTOCHROME B-C1
COMPLEX SUBUNIT 9
CYTOCHROME B-C1
COMPLEX SUBUNIT
RIESKE,
MITOCHONDRIAL)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
5 / 10 GLY A 270
SER A 272
ALA A 430
ASN A 169
VAL A 300
None
1.22A 6hu9L-4qyjA:
undetectable
6hu9P-4qyjA:
undetectable
6hu9T-4qyjA:
undetectable
6hu9L-4qyjA:
23.13
6hu9P-4qyjA:
17.25
6hu9T-4qyjA:
8.58
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.
6HU9_T_PCFT101_0
(CYTOCHROME B-C1
COMPLEX SUBUNIT 1,
MITOCHONDRIAL
CYTOCHROME B-C1
COMPLEX SUBUNIT 9
CYTOCHROME B-C1
COMPLEX SUBUNIT
RIESKE,
MITOCHONDRIAL)
4qyj ALDEHYDE
DEHYDROGENASE

(Pseudomonas
putida)
5 / 10 MET A 174
GLY A 270
SER A 272
ALA A 430
VAL A 300
None
1.48A 6hu9L-4qyjA:
undetectable
6hu9P-4qyjA:
undetectable
6hu9T-4qyjA:
undetectable
6hu9L-4qyjA:
23.13
6hu9P-4qyjA:
17.25
6hu9T-4qyjA:
8.58