SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3buj'

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.
1B02_A_C2FA281_0
(PROTEIN (THYMIDYLATE
SYNTHASE))		 3buj CALO2
(Micromonospora
echinospora) 		5 / 11 ALA A 138
ILE A 110
LEU A 145
GLY A 144
ALA A 102
 None
 1.13A 1b02A-3bujA:
undetectable		 1b02A-3bujA:
18.50
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.
1FO4_A_SALA3005_1
(XANTHINE
DEHYDROGENASE)		 3buj CALO2
(Micromonospora
echinospora) 		5 / 9 LEU A 167
PHE A  81
THR A  63
VAL A  66
LEU A  71
 None
 1.14A 1fo4A-3bujA:
1.0		 1fo4A-3bujA:
15.07
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.
1SN0_B_T44B602_1
(TRANSTHYRETIN)		 3buj CALO2
(Micromonospora
echinospora) 		4 / 7 LEU A 249
ALA A 361
LEU A 266
ALA A 269
 None
 1.02A 1sn0B-3bujA:
undetectable
1sn0D-3bujA:
undetectable		 1sn0B-3bujA:
16.99
1sn0D-3bujA:
16.99
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.
1WRQ_A_HISA2001_0
(HUT OPERON POSITIVE
REGULATORY PROTEIN)		 3buj CALO2
(Micromonospora
echinospora) 		4 / 6 ARG A 296
ARG A  30
GLY A  31
ALA A  32
 None
 1.01A 1wrqA-3bujA:
undetectable		 1wrqA-3bujA:
17.56
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.
2E1Q_C_SALC4006_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)		 3buj CALO2
(Micromonospora
echinospora) 		4 / 6 PHE A  81
THR A  63
VAL A  66
LEU A  71
 None
 1.00A 2e1qC-3bujA:
0.8		 2e1qC-3bujA:
15.49
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.
2EIL_P_CHDP1271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE
VIIA-HEART
CYTOCHROME C OXIDASE
SUBUNIT 3)		 3buj CALO2
(Micromonospora
echinospora) 		4 / 8 ARG A 260
LEU A 256
GLN A 255
LEU A 366
 None
 0.99A 2eilP-3bujA:
undetectable
2eilW-3bujA:
undetectable		 2eilP-3bujA:
18.05
2eilW-3bujA:
8.97
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.
2QQC_E_AG2E671_1
(PYRUVOYL-DEPENDENT
ARGININE
DECARBOXYLASE (EC
4.1.1.19) (PVLARGDC))		 3buj CALO2
(Micromonospora
echinospora) 		4 / 7 GLN A 352
LEU A 348
LEU A 146
GLY A 147
 None
HEM  A 398 ( 4.4A)
None
None
 0.89A 2qqcD-3bujA:
undetectable
2qqcE-3bujA:
undetectable		 2qqcD-3bujA:
13.74
2qqcE-3bujA:
7.47
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.
2X7H_A_PFNA1375_1
(ZINC-BINDING ALCOHOL
DEHYDROGENASE
DOMAIN-CONTAINING
PROTEIN 2)		 3buj CALO2
(Micromonospora
echinospora) 		4 / 5 SER A 333
TYR A 318
PHE A  41
VAL A  44
 None
 1.37A 2x7hA-3bujA:
undetectable		 2x7hA-3bujA:
21.43
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.
2X7H_B_PFNB1372_1
(ZINC-BINDING ALCOHOL
DEHYDROGENASE
DOMAIN-CONTAINING
PROTEIN 2)		 3buj CALO2
(Micromonospora
echinospora) 		4 / 5 SER A 333
TYR A 318
PHE A  41
VAL A  44
 None
 1.38A 2x7hB-3bujA:
undetectable		 2x7hB-3bujA:
21.43
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.
3AX7_A_SALA1336_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)		 3buj CALO2
(Micromonospora
echinospora) 		4 / 8 PHE A  81
THR A  63
VAL A  66
LEU A  71
 None
 1.01A 3ax7A-3bujA:
undetectable		 3ax7A-3bujA:
15.07
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.
3DDY_A_RBFA187_1
(LUMAZINE PROTEIN)		 3buj CALO2
(Micromonospora
echinospora) 		5 / 12 VAL A 305
SER A 282
ASN A 283
THR A 284
THR A 237
 None
None
HEM  A 398 (-3.6A)
None
HEM  A 398 (-3.7A)
 1.13A 3ddyA-3bujA:
undetectable		 3ddyA-3bujA:
17.48
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.
3LP9_D_SPMD230_1
(LS-24)		 3buj CALO2
(Micromonospora
echinospora) 		3 / 3 GLU A 191
GLU A  73
ASN A 221
 None
 0.67A 3lp9B-3bujA:
undetectable
3lp9D-3bujA:
undetectable		 3lp9B-3bujA:
18.23
3lp9D-3bujA:
18.23
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3R9C_A_ECLA452_1
(CYTOCHROME P450
164A2)		 3buj CALO2
(Micromonospora
echinospora) 		5 / 12 SER A 248
ALA A 358
LEU A 360
ALA A 356
LEU A 353
 None
 0.73A 3r9cA-3bujA:
44.3		 3r9cA-3bujA:
33.10
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.
3RAE_H_LFXH101_1
(DNA TOPOISOMERASE 4
SUBUNIT A
DNA TOPOISOMERASE 4
SUBUNIT B)		 3buj CALO2
(Micromonospora
echinospora) 		4 / 5 SER A 346
GLY A 339
GLU A  84
GLU A  51
 None
 1.35A 3raeB-3bujA:
0.5
3raeD-3bujA:
undetectable		 3raeB-3bujA:
23.22
3raeD-3bujA:
19.56
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.
3ROX_A_TEPA266_1
(APOLIPOPROTEIN
A-I-BINDING PROTEIN)		 3buj CALO2
(Micromonospora
echinospora) 		4 / 8 ALA A 111
VAL A 114
ASP A 115
LEU A 118
 None
 0.66A 3roxA-3bujA:
undetectable		 3roxA-3bujA:
20.15
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.
3UNA_A_SALA1340_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)		 3buj CALO2
(Micromonospora
echinospora) 		5 / 9 LEU A 167
PHE A  81
THR A  63
VAL A  66
LEU A  71
 None
 1.11A 3unaA-3bujA:
undetectable		 3unaA-3bujA:
15.52
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.
3UNA_B_SALB1340_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)		 3buj CALO2
(Micromonospora
echinospora) 		5 / 9 LEU A 167
PHE A  81
THR A  63
VAL A  66
LEU A  71
 None
 1.11A 3unaB-3bujA:
0.9		 3unaB-3bujA:
15.52
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.
3UNC_A_SALA1338_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)		 3buj CALO2
(Micromonospora
echinospora) 		5 / 9 LEU A 167
PHE A  81
THR A  63
VAL A  66
LEU A  71
 None
 1.09A 3uncA-3bujA:
0.6		 3uncA-3bujA:
15.52
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.
3UNC_B_SALB1338_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)		 3buj CALO2
(Micromonospora
echinospora) 		5 / 9 LEU A 167
PHE A  81
THR A  63
VAL A  66
LEU A  71
 None
 1.11A 3uncB-3bujA:
1.4		 3uncB-3bujA:
15.52
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.
3UNI_A_SALA1344_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)		 3buj CALO2
(Micromonospora
echinospora) 		4 / 7 PHE A  81
THR A  63
VAL A  66
LEU A  71
 None
 1.00A 3uniA-3bujA:
undetectable		 3uniA-3bujA:
15.52
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.
3WIP_G_ACTG306_0
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 3buj CALO2
(Micromonospora
echinospora) 		3 / 3 ARG A 275
ARG A 320
ASP A 322
 None
 0.96A 3wipG-3bujA:
undetectable
3wipH-3bujA:
undetectable		 3wipG-3bujA:
19.95
3wipH-3bujA:
19.95
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.
4V2O_B_CLQB1079_0
(SAPOSIN-B)		 3buj CALO2
(Micromonospora
echinospora) 		3 / 3 MET A 127
GLU A 132
LEU A 133
 None
 0.60A 4v2oB-3bujA:
undetectable		 4v2oB-3bujA:
11.31
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.
5BTA_G_MFXG101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
TTACGTGCATAGTCATTCAT
GACC)		 3buj CALO2
(Micromonospora
echinospora) 		4 / 7 ARG A 275
ASP A 277
ARG A 384
GLY A 309
 None
 0.97A 5btaA-3bujA:
undetectable
5btaC-3bujA:
0.7
5btaD-3bujA:
undetectable		 5btaA-3bujA:
23.87
5btaC-3bujA:
23.87
5btaD-3bujA:
20.80
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.
5BTD_G_GFNG101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
TTACGTGCATAGTCATTCAT
GACC)		 3buj CALO2
(Micromonospora
echinospora) 		4 / 7 ARG A 275
ASP A 277
ARG A 384
GLY A 309
 None
 1.01A 5btdA-3bujA:
undetectable
5btdC-3bujA:
0.7
5btdD-3bujA:
undetectable		 5btdA-3bujA:
23.87
5btdC-3bujA:
23.87
5btdD-3bujA:
20.80
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.
5BTF_G_GFNG101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
TTACGTGCATAGTCATTCAT
GACC)		 3buj CALO2
(Micromonospora
echinospora) 		4 / 7 ARG A 275
ASP A 277
ARG A 384
GLY A 309
 None
 0.99A 5btfA-3bujA:
undetectable
5btfC-3bujA:
0.8
5btfD-3bujA:
undetectable		 5btfA-3bujA:
23.87
5btfC-3bujA:
23.87
5btfD-3bujA:
20.80
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.
5IKT_A_TLFA601_0
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3buj CALO2
(Micromonospora
echinospora) 		5 / 12 VAL A 190
LEU A 106
VAL A 142
GLY A 144
LEU A 206
 None
 0.89A 5iktA-3bujA:
1.0		 5iktA-3bujA:
20.63
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.
5IKT_B_TLFB601_0
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3buj CALO2
(Micromonospora
echinospora) 		5 / 12 VAL A 190
LEU A 106
VAL A 142
GLY A 144
LEU A 206
 None
 0.90A 5iktB-3bujA:
undetectable		 5iktB-3bujA:
20.63
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.
5OTR_A_ACTA402_0
(CASEIN KINASE II
SUBUNIT ALPHA)		 3buj CALO2
(Micromonospora
echinospora) 		4 / 5 TYR A  19
ASP A 314
PRO A 315
ALA A 311
 None
 0.99A 5otrA-3bujA:
undetectable		 5otrA-3bujA:
23.83
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.
5OY0_1_PQN1842_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1
PHOTOSYSTEM I
REACTION CENTER
SUBUNIT IX)		 3buj CALO2
(Micromonospora
echinospora) 		5 / 10 ARG A 140
LEU A 143
GLY A 144
ILE A 183
LEU A  70
 None
 1.27A 5oy01-3bujA:
undetectable
5oy07-3bujA:
undetectable		 5oy01-3bujA:
12.29
5oy07-3bujA:
5.57
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.
6DJ1_B_AB1B201_0
(HIV-1 PROTEASE)		 3buj CALO2
(Micromonospora
echinospora) 		5 / 12 GLY A 170
ALA A 171
ASP A 175
VAL A  66
GLY A 164
 None
 0.83A 6dj1A-3bujA:
undetectable		 6dj1A-3bujA:
11.31
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.
6E43_A_BEZA502_0
(INDOLEAMINE
2,3-DIOXYGENASE 1)		 3buj CALO2
(Micromonospora
echinospora) 		4 / 6 VAL A 246
LEU A 259
LEU A 256
HIS A 252
 None
 1.00A 6e43A-3bujA:
undetectable		 6e43A-3bujA:
23.04
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.
6E43_B_BEZB502_0
(INDOLEAMINE
2,3-DIOXYGENASE 1)		 3buj CALO2
(Micromonospora
echinospora) 		4 / 6 VAL A 246
LEU A 259
LEU A 256
HIS A 252
 None
 1.02A 6e43B-3bujA:
undetectable		 6e43B-3bujA:
23.04
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.
6E43_C_BEZC502_0
(INDOLEAMINE
2,3-DIOXYGENASE 1)		 3buj CALO2
(Micromonospora
echinospora) 		4 / 6 VAL A 246
LEU A 259
LEU A 256
HIS A 252
 None
 1.00A 6e43C-3bujA:
undetectable		 6e43C-3bujA:
23.04
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.
6EKU_A_ZMRA901_2
(SIALIDASE)		 3buj CALO2
(Micromonospora
echinospora) 		4 / 6 GLN A 241
ASN A 244
LEU A 274
PHE A 336
 None
None
None
HEM  A 398 (-4.8A)
 0.99A 6ekuA-3bujA:
undetectable		 6ekuA-3bujA:
19.53