SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2j42'

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.
1HPK_A_ACAA80_1
(PLASMINOGEN)		 2j42 C2 TOXIN
COMPONENT-II
(Clostridium
botulinum) 		4 / 6 PRO A 237
ASN A 378
TRP A 476
TYR A 479
 None
 1.29A 1hpkA-2j42A:
undetectable		 1hpkA-2j42A:
7.07
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.
2ADM_A_SAMA500_0
(ADENINE-N6-DNA-METHY
LTRANSFERASE TAQI)		 2j42 C2 TOXIN
COMPONENT-II
(Clostridium
botulinum) 		5 / 11 THR A 515
ALA A 488
ILE A 585
ALA A 523
ASP A 555
 None
 1.34A 2admA-2j42A:
undetectable		 2admA-2j42A:
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.
2ADM_B_SAMB500_0
(ADENINE-N6-DNA-METHY
LTRANSFERASE TAQI)		 2j42 C2 TOXIN
COMPONENT-II
(Clostridium
botulinum) 		5 / 11 THR A 515
ALA A 488
ILE A 585
ALA A 523
ASP A 555
 None
 1.27A 2admB-2j42A:
undetectable		 2admB-2j42A:
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.
2DR2_A_TRPA479_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 2j42 C2 TOXIN
COMPONENT-II
(Clostridium
botulinum) 		5 / 11 TYR A  26
GLY A  22
ILE A  38
GLN A 247
PHE A 241
 None
 1.43A 2dr2A-2j42A:
undetectable		 2dr2A-2j42A:
17.28
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.
2DU8_A_BEZA352_0
(D-AMINO-ACID OXIDASE)		 2j42 C2 TOXIN
COMPONENT-II
(Clostridium
botulinum) 		4 / 6 LEU A  92
TYR A 115
ILE A  71
GLY A  77
 None
 0.87A 2du8A-2j42A:
undetectable		 2du8A-2j42A:
17.29
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.
2DU8_B_BEZB1352_0
(D-AMINO-ACID OXIDASE)		 2j42 C2 TOXIN
COMPONENT-II
(Clostridium
botulinum) 		4 / 6 LEU A  92
TYR A 115
ILE A  71
GLY A  77
 None
 0.91A 2du8B-2j42A:
undetectable		 2du8B-2j42A:
17.29
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.
2O5Y_H_STRH249_1
(CHIMERIC ANTIBODY
FAB 1E9-DB3)		 2j42 C2 TOXIN
COMPONENT-II
(Clostridium
botulinum) 		4 / 7 GLY A 446
THR A 448
TRP A 334
SER A 298
 None
 1.21A 2o5yH-2j42A:
undetectable
2o5yL-2j42A:
undetectable		 2o5yH-2j42A:
16.05
2o5yL-2j42A:
15.91
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.
3AF0_A_PAUA314_0
(PANTOTHENATE KINASE)		 2j42 C2 TOXIN
COMPONENT-II
(Clostridium
botulinum) 		4 / 8 VAL A 114
LYS A 156
GLY A  69
TYR A 463
 None
 0.95A 3af0A-2j42A:
undetectable		 3af0A-2j42A:
18.08
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.
3DGQ_A_EAAA211_1
(GLUTATHIONE
S-TRANSFERASE P)		 2j42 C2 TOXIN
COMPONENT-II
(Clostridium
botulinum) 		4 / 5 TYR A 377
ILE A 248
TYR A 238
THR A 239
 None
 1.34A 3dgqA-2j42A:
undetectable		 3dgqA-2j42A:
13.91
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.
3K2H_B_LYAB514_2
(DIHYDROFOLATE
REDUCTASE/THYMIDYLAT
E SYNTHASE)		 2j42 C2 TOXIN
COMPONENT-II
(Clostridium
botulinum) 		3 / 3 ARG A 367
THR A 491
THR A 453
 None
 0.71A 3k2hB-2j42A:
undetectable		 3k2hB-2j42A:
21.76
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.
3QPS_A_CHDA211_0
(CMER)		 2j42 C2 TOXIN
COMPONENT-II
(Clostridium
botulinum) 		5 / 10 LEU A  35
ALA A  65
GLY A  25
ILE A  38
TRP A 197
 None
 1.35A 3qpsA-2j42A:
undetectable		 3qpsA-2j42A:
15.40
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.
4A9K_A_TYLA2200_1
(CREB-BINDING PROTEIN)		 2j42 C2 TOXIN
COMPONENT-II
(Clostridium
botulinum) 		4 / 6 LEU A  46
ILE A 135
ASN A  98
VAL A  90
 None
 0.81A 4a9kA-2j42A:
undetectable		 4a9kA-2j42A:
10.07
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.
4A9K_B_TYLB2198_1
(CREB-BINDING PROTEIN)		 2j42 C2 TOXIN
COMPONENT-II
(Clostridium
botulinum) 		4 / 5 LEU A  46
ILE A 135
ASN A  98
VAL A  90
 None
 0.74A 4a9kB-2j42A:
undetectable		 4a9kB-2j42A:
10.07
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.
5VOO_A_C2FA3001_1
(5-METHYLTETRAHYDROFO
LATE HOMOCYSTEINE
S-METHYLTRANSFERASE)		 2j42 C2 TOXIN
COMPONENT-II
(Clostridium
botulinum) 		4 / 5 ASN A 235
ASN A 161
ASP A 191
ASN A 227
 None
 1.47A 5vooA-2j42A:
undetectable		 5vooA-2j42A:
17.15
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.
5XIW_D_LOCD503_2
(TUBULIN BETA CHAIN)		 2j42 C2 TOXIN
COMPONENT-II
(Clostridium
botulinum) 		5 / 12 LEU A 520
LEU A 518
ALA A 523
LEU A 490
ALA A 505
 None
 1.32A 5xiwD-2j42A:
undetectable		 5xiwD-2j42A:
7.59