SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'SCY'


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.
1E7A_A_PFLA4001_1
(SERUM ALBUMIN)		 4x0o 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3 PROTEIN 2
(Vibrio
cholerae) 		5 / 9 LEU A 261
ILE A 257
LEU A 117
GLY A 312
ALA A 223
 None
None
None
SCY  A 113 ( 3.1A)
None
 1.26A 1e7aA-4x0oA:
undetectable		 1e7aA-4x0oA:
20.72
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.
1HVY_B_D16B415_1
(THYMIDYLATE SYNTHASE)		 4x0o 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3 PROTEIN 2
(Vibrio
cholerae) 		5 / 12 ILE A 257
ASN A 281
GLY A 216
PHE A 220
ALA A 313
 None
SCY  A 113 ( 3.7A)
None
None
SCY  A 113 ( 3.9A)
 1.35A 1hvyB-4x0oA:
undetectable		 1hvyB-4x0oA:
23.68
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.
1JU6_A_LYAA317_1
(THYMIDYLATE SYNTHASE)		 4x0o 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3 PROTEIN 2
(Vibrio
cholerae) 		5 / 11 ILE A 257
ASN A 281
GLY A 216
PHE A 220
ALA A 313
 None
SCY  A 113 ( 3.7A)
None
None
SCY  A 113 ( 3.9A)
 1.36A 1ju6A-4x0oA:
undetectable		 1ju6A-4x0oA:
24.76
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.
1JU6_C_LYAC315_1
(THYMIDYLATE SYNTHASE)		 4x0o 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3 PROTEIN 2
(Vibrio
cholerae) 		5 / 10 ILE A 257
ASN A 281
GLY A 216
PHE A 220
ALA A 313
 None
SCY  A 113 ( 3.7A)
None
None
SCY  A 113 ( 3.9A)
 1.36A 1ju6C-4x0oA:
undetectable		 1ju6C-4x0oA:
24.76
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.
1NV8_B_SAMB301_0
(HEMK PROTEIN)		 1dm3 BIOSYNTHETIC
THIOLASE ACETYLATED
AT CYS89
(Zoogloea
ramigera) 		5 / 12 ILE A 379
GLY A  90
GLY A 354
ILE A 350
ALA A  95
 SCY  A  89 ( 4.6A)
SCY  A  89 ( 2.4A)
SCY  A  89 ( 4.6A)
SCY  A  89 ( 4.5A)
None
 1.03A 1nv8B-1dm3A:
undetectable		 1nv8B-1dm3A:
22.61
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.
1Q23_A_FUAA702_1
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 4nhd 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3 PROTEIN 1
(Vibrio
cholerae) 		5 / 12 THR A 278
SER A 275
LEU A 189
VAL A 211
ALA A 215
 None
SCY  A 112 ( 3.3A)
COA  A 401 (-4.2A)
COA  A 401 (-3.9A)
None
 1.34A 1q23A-4nhdA:
undetectable
1q23B-4nhdA:
undetectable		 1q23A-4nhdA:
21.97
1q23B-4nhdA:
21.97
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.
1Q23_H_FUAH709_1
(CHLORAMPHENICOL
ACETYLTRANSFERASE)		 4nhd 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3 PROTEIN 1
(Vibrio
cholerae) 		5 / 12 SER A 275
LEU A 189
VAL A 211
VAL A 216
ALA A 215
 SCY  A 112 ( 3.3A)
COA  A 401 (-4.2A)
COA  A 401 (-3.9A)
None
None
 1.20A 1q23H-4nhdA:
undetectable
1q23I-4nhdA:
undetectable		 1q23H-4nhdA:
21.97
1q23I-4nhdA:
21.97
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.
1QKN_A_RALA600_1
(ESTROGEN RECEPTOR
BETA)		 1dm3 BIOSYNTHETIC
THIOLASE ACETYLATED
AT CYS89
(Zoogloea
ramigera) 		6 / 12 LEU A 377
THR A 376
ALA A 375
LEU A 361
ILE A 346
GLY A 342
 SCY  A  89 ( 3.8A)
None
None
None
None
None
 1.50A 1qknA-1dm3A:
undetectable		 1qknA-1dm3A:
21.12
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.
1SG9_B_SAMB302_0
(HEMK PROTEIN)		 1dm3 BIOSYNTHETIC
THIOLASE ACETYLATED
AT CYS89
(Zoogloea
ramigera) 		5 / 12 ILE A 379
GLY A  90
GLY A 354
ILE A 350
ALA A  95
 SCY  A  89 ( 4.6A)
SCY  A  89 ( 2.4A)
SCY  A  89 ( 4.6A)
SCY  A  89 ( 4.5A)
None
 0.98A 1sg9B-1dm3A:
undetectable		 1sg9B-1dm3A:
22.36
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.
1UW6_A_NCTA1208_1
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 5g3p FORMAMIDASE
(Bacillus
cereus) 		4 / 8 TYR A 191
CYH A 163
TRP A 199
LEU A 185
 SCY  A 165 ( 3.4A)
None
None
None
 1.38A 1uw6A-5g3pA:
undetectable
1uw6B-5g3pA:
undetectable		 1uw6A-5g3pA:
19.54
1uw6B-5g3pA:
19.54
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.
1UW6_D_NCTD1208_1
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 5g3p FORMAMIDASE
(Bacillus
cereus) 		4 / 8 TYR A 191
CYH A 163
TRP A 199
LEU A 185
 SCY  A 165 ( 3.4A)
None
None
None
 1.37A 1uw6D-5g3pA:
undetectable
1uw6E-5g3pA:
undetectable		 1uw6D-5g3pA:
19.54
1uw6E-5g3pA:
19.54
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.
1UW6_G_NCTG1206_1
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 5g3p FORMAMIDASE
(Bacillus
cereus) 		4 / 8 TYR A 191
CYH A 163
TRP A 199
LEU A 185
 SCY  A 165 ( 3.4A)
None
None
None
 1.39A 1uw6G-5g3pA:
undetectable
1uw6H-5g3pA:
undetectable		 1uw6G-5g3pA:
19.54
1uw6H-5g3pA:
19.54
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.
1UW6_T_NCTT1208_1
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 5g3p FORMAMIDASE
(Bacillus
cereus) 		4 / 8 TRP A 199
LEU A 185
TYR A 191
CYH A 163
 None
None
SCY  A 165 ( 3.4A)
None
 1.45A 1uw6P-5g3pA:
undetectable
1uw6T-5g3pA:
undetectable		 1uw6P-5g3pA:
19.54
1uw6T-5g3pA:
19.54
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.
1YA4_A_CTXA1_1
(CES1 PROTEIN)		 5w40 POPP2 PROTEIN
(Ralstonia
solanacearum) 		5 / 12 GLY A 385
SER A 390
LEU A 324
SER A 325
LEU A 281
 None
None
SCY  A 321 ( 4.8A)
SCY  A 321 ( 3.0A)
COA  A 502 (-4.5A)
 1.00A 1ya4A-5w40A:
undetectable		 1ya4A-5w40A:
21.72
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.
2AVD_A_SAMA501_0
(CATECHOL-O-METHYLTRA
NSFERASE)		 2p8u HYDROXYMETHYLGLUTARY
L-COA SYNTHASE,
CYTOPLASMIC
(Homo
sapiens) 		5 / 12 GLY A 132
TYR A 375
SER A 374
VAL A 156
ALA A 135
 None
None
SCY  A 129 ( 4.2A)
None
None
 1.38A 2avdA-2p8uA:
undetectable		 2avdA-2p8uA:
18.84
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.
2BM9_C_SAMC301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 5mg5 2,4-DIACETYLPHLOROGL
UCINOL BIOSYNTHESIS
PROTEIN PHLC
(Pseudomonas
protegens) 		5 / 12 LEU C 360
ASN C 337
CYH C 277
ASN C 382
ALA C 240
 None
None
None
SCY  C  88 ( 3.5A)
None
 1.09A 2bm9C-5mg5C:
undetectable		 2bm9C-5mg5C:
undetectable
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.
2F16_2_BO221405_1
(PROTEASOME COMPONENT
PRE3)		 2p8u HYDROXYMETHYLGLUTARY
L-COA SYNTHASE,
CYTOPLASMIC
(Homo
sapiens) 		5 / 11 THR A 126
THR A 125
SER A 377
GLY A 376
ALA A 380
 None
None
SCY  A 129 ( 3.6A)
SCY  A 129 ( 3.5A)
None
 0.87A 2f162-2p8uA:
undetectable		 2f162-2p8uA:
18.10
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.
2F16_2_BO221405_1
(PROTEASOME COMPONENT
PRE3)		 3il3 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3
(Haemophilus
influenzae) 		5 / 11 ALA A  79
SER A 311
GLY A 310
ALA A 302
SER A 120
 None
None
None
SCY  A 112 ( 3.8A)
None
 1.06A 2f162-3il3A:
undetectable		 2f162-3il3A:
22.12
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.
2F16_N_BO2N1404_1
(PROTEASOME COMPONENT
PRE3)		 2p8u HYDROXYMETHYLGLUTARY
L-COA SYNTHASE,
CYTOPLASMIC
(Homo
sapiens) 		5 / 11 THR A 126
THR A 125
SER A 377
GLY A 376
ALA A 380
 None
None
SCY  A 129 ( 3.6A)
SCY  A 129 ( 3.5A)
None
 0.87A 2f16N-2p8uA:
undetectable		 2f16N-2p8uA:
18.10
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.
2F16_N_BO2N1404_1
(PROTEASOME COMPONENT
PRE3)		 3il3 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3
(Haemophilus
influenzae) 		5 / 11 ALA A  79
SER A 311
GLY A 310
ALA A 302
SER A 120
 None
None
None
SCY  A 112 ( 3.8A)
None
 1.06A 2f16N-3il3A:
undetectable		 2f16N-3il3A:
22.12
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.
2OKC_A_SAMA500_0
(TYPE I RESTRICTION
ENZYME STYSJI M
PROTEIN)		 3il3 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3
(Haemophilus
influenzae) 		5 / 12 TYR A 117
ILE A 137
GLY A 114
GLY A 138
THR A 308
 None
None
SCY  A 112 ( 4.4A)
None
None
 1.11A 2okcA-3il3A:
undetectable		 2okcA-3il3A:
22.29
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.
2OXT_C_SAMC300_0
(NUCLEOSIDE-2'-O-METH
YLTRANSFERASE)		 1dm3 BIOSYNTHETIC
THIOLASE ACETYLATED
AT CYS89
(Zoogloea
ramigera) 		5 / 12 GLY A  90
GLY A 354
GLY A 114
ILE A 379
VAL A 385
 SCY  A  89 ( 2.4A)
SCY  A  89 ( 4.6A)
None
SCY  A  89 ( 4.6A)
None
 0.96A 2oxtC-1dm3A:
undetectable		 2oxtC-1dm3A:
22.59
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.
2PKM_A_ADNA501_1
(ADENOSINE KINASE)		 2p8u HYDROXYMETHYLGLUTARY
L-COA SYNTHASE,
CYTOPLASMIC
(Homo
sapiens) 		5 / 12 ALA A 134
GLY A 132
GLY A 131
GLY A 158
ASP A 159
 None
None
SCY  A 129 ( 4.9A)
None
None
 0.90A 2pkmA-2p8uA:
undetectable		 2pkmA-2p8uA:
23.52
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.
2XFH_A_CL6A1414_1
(ERYTHROMYCIN B/D
C-12 HYDROXYLASE)		 2bv5 TYROSINE-PROTEIN
PHOSPHATASE,
NON-RECEPTOR TYPE 5
(Homo
sapiens) 		5 / 8 HIS A 471
LEU A 418
ILE A 416
LEU A 427
THR A 368
 SCY  A 472 ( 4.2A)
None
None
None
None
 1.39A 2xfhA-2bv5A:
undetectable		 2xfhA-2bv5A:
19.71
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.
2Y00_B_Y00B601_1
(BETA-1 ADRENERGIC
RECEPTOR)		 5mg5 2,4-DIACETYLPHLOROGL
UCINOL BIOSYNTHESIS
PROTEIN PHLC
(Pseudomonas
protegens) 		5 / 12 VAL C 372
THR C 358
SER C  91
SER C  94
ASN C 382
 None
None
None
None
SCY  C  88 ( 3.5A)
 1.26A 2y00B-5mg5C:
undetectable		 2y00B-5mg5C:
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.
2Y01_B_Y00B601_1
(BETA-1 ADRENERGIC
RECEPTOR)		 5mg5 2,4-DIACETYLPHLOROGL
UCINOL BIOSYNTHESIS
PROTEIN PHLC
(Pseudomonas
protegens) 		5 / 12 VAL C 372
THR C 358
SER C  91
SER C  94
ASN C 382
 None
None
None
None
SCY  C  88 ( 3.5A)
 1.24A 2y01B-5mg5C:
undetectable		 2y01B-5mg5C:
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.
2ZIF_B_SAMB298_0
(PUTATIVE
MODIFICATION
METHYLASE)		 5mg5 2,4-DIACETYLPHLOROGL
UCINOL BIOSYNTHESIS
PROTEIN PHLC
(Pseudomonas
protegens) 		5 / 12 ALA C 147
SER C 131
ALA C  86
GLY C 384
THR C  89
 None
None
None
SCY  C  88 ( 3.5A)
SCY  C  88 ( 3.8A)
 1.21A 2zifB-5mg5C:
undetectable		 2zifB-5mg5C:
undetectable
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.
3AG4_B_CHDB1085_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 2
CYTOCHROME C OXIDASE
SUBUNIT 6A2)		 6bn2 ACETYL-COA
ACETYLTRANSFERASE
(Elizabethkingia
anophelis) 		5 / 12 MET A 156
GLY A 157
THR A 242
THR A 240
PHE A 288
 SCY  A  88 ( 4.8A)
SCY  A 159 ( 4.2A)
None
None
SCY  A 159 ( 4.6A)
 1.50A 3ag4A-6bn2A:
0.2
3ag4B-6bn2A:
undetectable
3ag4T-6bn2A:
undetectable		 3ag4A-6bn2A:
undetectable
3ag4B-6bn2A:
undetectable
3ag4T-6bn2A:
undetectable
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.
3ARU_A_PNXA606_1
(CHITINASE A)		 4z19 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3
(Yersinia
pestis) 		4 / 7 PHE A 303
GLY A 305
ASP A 182
ARG A 184
 None
SCY  A 112 ( 3.9A)
None
None
 0.95A 3aruA-4z19A:
undetectable		 3aruA-4z19A:
20.34
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.
3KU1_A_SAMA226_0
(SAM-DEPENDENT
METHYLTRANSFERASE)		 2bv5 TYROSINE-PROTEIN
PHOSPHATASE,
NON-RECEPTOR TYPE 5
(Homo
sapiens) 		6 / 12 GLY A 475
VAL A 470
GLY A 513
MET A 514
LEU A 507
ILE A 335
 SCY  A 472 ( 3.6A)
None
None
None
None
None
 1.29A 3ku1A-2bv5A:
undetectable		 3ku1A-2bv5A:
22.80
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.
3KU1_C_SAMC226_0
(SAM-DEPENDENT
METHYLTRANSFERASE)		 2bv5 TYROSINE-PROTEIN
PHOSPHATASE,
NON-RECEPTOR TYPE 5
(Homo
sapiens) 		6 / 12 GLY A 475
VAL A 470
GLY A 513
MET A 514
LEU A 507
ILE A 335
 SCY  A 472 ( 3.6A)
None
None
None
None
None
 1.27A 3ku1C-2bv5A:
undetectable		 3ku1C-2bv5A:
22.80
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.
3KU9_B_SPMB700_1
(POLYAMINE OXIDASE)		 5g3p FORMAMIDASE
(Bacillus
cereus) 		4 / 7 GLU A  60
GLU A 140
TYR A 191
TYR A  61
 SCY  A 165 ( 3.2A)
SCY  A 165 ( 3.7A)
SCY  A 165 ( 3.4A)
None
 1.05A 3ku9B-5g3pA:
undetectable		 3ku9B-5g3pA:
22.42
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.
3KZ7_A_RAPA225_1
(FK506-BINDING
PROTEIN 3)		 5mg5 2,4-DIACETYLPHLOROGL
UCINOL BIOSYNTHESIS
PROTEIN PHLC
(Pseudomonas
protegens) 		5 / 10 TYR C 298
ASP C 352
LEU C 300
ILE C 128
TYR C 124
 SCY  C  88 (-4.2A)
None
None
13X  C 500 (-3.9A)
13X  C 500 (-4.9A)
 1.17A 3kz7A-5mg5C:
undetectable		 3kz7A-5mg5C:
18.60
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.
3MG0_2_BO221405_1
(PROTEASOME COMPONENT
PRE3
PROTEASOME COMPONENT
PUP1)		 2p8u HYDROXYMETHYLGLUTARY
L-COA SYNTHASE,
CYTOPLASMIC
(Homo
sapiens) 		5 / 12 THR A 126
THR A 125
SER A 377
GLY A 376
ALA A 380
 None
None
SCY  A 129 ( 3.6A)
SCY  A 129 ( 3.5A)
None
 0.85A 3mg02-2p8uA:
undetectable
3mg0V-2p8uA:
undetectable		 3mg02-2p8uA:
18.10
3mg0V-2p8uA:
18.63
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.
3MG0_2_BO221405_1
(PROTEASOME COMPONENT
PRE3
PROTEASOME COMPONENT
PUP1)		 3il3 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3
(Haemophilus
influenzae) 		5 / 12 ALA A  79
SER A 311
GLY A 310
ALA A 302
SER A 120
 None
None
None
SCY  A 112 ( 3.8A)
None
 1.11A 3mg02-3il3A:
undetectable
3mg0V-3il3A:
undetectable		 3mg02-3il3A:
22.12
3mg0V-3il3A:
22.81
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.
3MG0_N_BO2N1404_1
(PROTEASOME COMPONENT
PRE3)		 2p8u HYDROXYMETHYLGLUTARY
L-COA SYNTHASE,
CYTOPLASMIC
(Homo
sapiens) 		5 / 11 THR A 126
THR A 125
SER A 377
GLY A 376
ALA A 380
 None
None
SCY  A 129 ( 3.6A)
SCY  A 129 ( 3.5A)
None
 0.86A 3mg0N-2p8uA:
undetectable		 3mg0N-2p8uA:
18.10
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.
3MG0_N_BO2N1404_1
(PROTEASOME COMPONENT
PRE3)		 3il3 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3
(Haemophilus
influenzae) 		5 / 11 ALA A  79
SER A 311
GLY A 310
ALA A 302
SER A 120
 None
None
None
SCY  A 112 ( 3.8A)
None
 1.11A 3mg0N-3il3A:
undetectable		 3mg0N-3il3A:
22.12
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.
3P2K_C_SAMC6735_0
(16S RRNA METHYLASE)		 4nhd 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3 PROTEIN 1
(Vibrio
cholerae) 		5 / 12 GLY A 306
GLY A 183
ALA A 110
ALA A 111
LEU A 188
 None
None
None
SCY  A 112 ( 2.7A)
None
 1.04A 3p2kC-4nhdA:
undetectable		 3p2kC-4nhdA:
23.85
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.
3P2K_C_SAMC6735_0
(16S RRNA METHYLASE)		 4z19 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3
(Yersinia
pestis) 		5 / 12 GLY A 306
GLY A 183
ALA A 110
ALA A 111
LEU A 188
 None
None
None
SCY  A 112 ( 2.7A)
None
 1.06A 3p2kC-4z19A:
undetectable		 3p2kC-4z19A:
20.49
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.
3P2K_D_SAMD6735_0
(16S RRNA METHYLASE)		 4nhd 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3 PROTEIN 1
(Vibrio
cholerae) 		5 / 12 GLY A 306
GLY A 183
ALA A 110
ALA A 111
LEU A 188
 None
None
None
SCY  A 112 ( 2.7A)
None
 1.05A 3p2kD-4nhdA:
undetectable		 3p2kD-4nhdA:
23.85
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.
3P2K_D_SAMD6735_0
(16S RRNA METHYLASE)		 4z19 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3
(Yersinia
pestis) 		5 / 12 GLY A 306
GLY A 183
ALA A 110
ALA A 111
LEU A 188
 None
None
None
SCY  A 112 ( 2.7A)
None
 1.04A 3p2kD-4z19A:
undetectable		 3p2kD-4z19A:
20.49
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.
3R9C_A_ECLA451_1
(CYTOCHROME P450
164A2)		 4z19 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3
(Yersinia
pestis) 		5 / 10 ALA A 254
LEU A 299
LEU A 219
ALA A 302
THR A 116
 None
None
None
SCY  A 112 ( 3.7A)
None
 1.15A 3r9cA-4z19A:
undetectable		 3r9cA-4z19A:
22.95
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.
3SUE_B_SUEB1201_1
(NS3 PROTEASE, NS4A
PROTEIN)		 2p8u HYDROXYMETHYLGLUTARY
L-COA SYNTHASE,
CYTOPLASMIC
(Homo
sapiens) 		5 / 12 GLY A 131
ARG A 231
SER A 374
PHE A 373
ALA A 228
 SCY  A 129 ( 4.9A)
None
SCY  A 129 ( 4.2A)
None
None
 1.20A 3sueB-2p8uA:
undetectable		 3sueB-2p8uA:
17.36
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.
3TWP_D_SALD404_1
(ANTHRANILATE
PHOSPHORIBOSYLTRANSF
ERASE)		 2p8u HYDROXYMETHYLGLUTARY
L-COA SYNTHASE,
CYTOPLASMIC
(Homo
sapiens) 		4 / 5 ASN A 127
ALA A 128
TYR A 375
ALA A 381
 None
SCY  A 129 ( 2.9A)
None
None
 1.29A 3twpD-2p8uA:
undetectable		 3twpD-2p8uA:
20.45
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.
3VN2_A_TLSA501_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 2p8u HYDROXYMETHYLGLUTARY
L-COA SYNTHASE,
CYTOPLASMIC
(Homo
sapiens) 		5 / 12 PHE A 327
HIS A 264
LEU A 383
LEU A 255
MET A 278
 None
SCY  A 129 ( 3.7A)
None
None
None
 1.36A 3vn2A-2p8uA:
undetectable		 3vn2A-2p8uA:
22.53
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.
4DF2_A_4CHA506_0
(NADPH DEHYDROGENASE)		 5mg5 2,4-DIACETYLPHLOROGL
UCINOL BIOSYNTHESIS
PROTEIN PHLC
(Pseudomonas
protegens) 		4 / 6 THR C  89
HIS C 144
HIS C 246
TYR C 241
 SCY  C  88 ( 3.8A)
13X  C 500 (-4.5A)
None
None
 1.35A 4df2A-5mg5C:
undetectable		 4df2A-5mg5C:
undetectable
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.
4MM8_A_RFXA603_1
(TRANSPORTER)		 4nhd 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3 PROTEIN 1
(Vibrio
cholerae) 		5 / 12 ASP A 182
VAL A 214
ALA A 215
GLY A 186
GLY A 304
 None
None
None
None
SCY  A 112 ( 3.3A)
 1.08A 4mm8A-4nhdA:
undetectable		 4mm8A-4nhdA:
21.56
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.
4OAE_A_CLMA207_0
(GNAT SUPERFAMILY
ACETYLTRANSFERASE
PA4794)		 1dm3 BIOSYNTHETIC
THIOLASE ACETYLATED
AT CYS89
(Zoogloea
ramigera) 		5 / 12 GLU A 198
ALA A 375
ALA A 355
GLY A 354
LEU A  93
 None
None
None
SCY  A  89 ( 4.6A)
None
 1.03A 4oaeA-1dm3A:
undetectable		 4oaeA-1dm3A:
19.23
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.
4OBW_A_SAMA602_0
(2-METHOXY-6-POLYPREN
YL-1,4-BENZOQUINOL
METHYLASE,
MITOCHONDRIAL)		 4x0o 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3 PROTEIN 2
(Vibrio
cholerae) 		5 / 12 ASN A 110
GLY A 312
ILE A 190
GLY A 216
PHE A 214
 None
SCY  A 113 ( 3.1A)
None
None
None
 1.20A 4obwA-4x0oA:
undetectable		 4obwA-4x0oA:
22.86
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.
4OBW_C_SAMC601_0
(2-METHOXY-6-POLYPREN
YL-1,4-BENZOQUINOL
METHYLASE,
MITOCHONDRIAL)		 4x0o 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3 PROTEIN 2
(Vibrio
cholerae) 		5 / 12 ASN A 110
GLY A 312
ILE A 190
GLY A 216
PHE A 214
 None
SCY  A 113 ( 3.1A)
None
None
None
 1.23A 4obwC-4x0oA:
undetectable		 4obwC-4x0oA:
22.86
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.
4ODO_A_FK5A205_1
(PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
SLYD)		 5mg5 2,4-DIACETYLPHLOROGL
UCINOL BIOSYNTHESIS
PROTEIN PHLC
(Pseudomonas
protegens) 		5 / 10 TYR C 298
ASP C 352
LEU C 300
ILE C 128
TYR C 124
 SCY  C  88 (-4.2A)
None
None
13X  C 500 (-3.9A)
13X  C 500 (-4.9A)
 1.08A 4odoA-5mg5C:
undetectable		 4odoA-5mg5C:
16.00
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.
4ODO_C_FK5C204_1
(PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
SLYD)		 5mg5 2,4-DIACETYLPHLOROGL
UCINOL BIOSYNTHESIS
PROTEIN PHLC
(Pseudomonas
protegens) 		5 / 10 TYR C 298
ASP C 352
LEU C 300
ILE C 128
TYR C 124
 SCY  C  88 (-4.2A)
None
None
13X  C 500 (-3.9A)
13X  C 500 (-4.9A)
 1.06A 4odoC-5mg5C:
undetectable		 4odoC-5mg5C:
16.00
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.
4RTP_A_SAMA301_0
(DNA ADENINE
METHYLASE)		 4z19 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3
(Yersinia
pestis) 		5 / 12 GLY A 138
ALA A 277
SER A 275
ILE A  76
SER A 105
 None
None
SCY  A 112 ( 3.5A)
None
None
 1.22A 4rtpA-4z19A:
undetectable		 4rtpA-4z19A:
20.11
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.
4UIL_H_QI9H1223_0
(FAB 314.1)		 3il3 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3
(Haemophilus
influenzae) 		5 / 12 HIS A 243
ALA A 245
GLY A 305
GLY A 310
LEU A 219
 SCY  A 112 ( 3.8A)
None
SCY  A 112 ( 4.1A)
None
None
 0.98A 4uilH-3il3A:
undetectable
4uilL-3il3A:
undetectable		 4uilH-3il3A:
19.64
4uilL-3il3A:
20.43
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.
4UIL_H_QI9H1223_0
(FAB 314.1)		 4nhd 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3 PROTEIN 1
(Vibrio
cholerae) 		5 / 12 HIS A 243
ALA A 245
GLY A 305
GLY A 310
LEU A 219
 SCY  A 112 (-3.8A)
COA  A 401 (-3.3A)
SCY  A 112 ( 3.8A)
None
None
 1.03A 4uilH-4nhdA:
undetectable
4uilL-4nhdA:
undetectable		 4uilH-4nhdA:
19.81
4uilL-4nhdA:
21.54
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.
4WNU_B_QDNB602_1
(CYTOCHROME P450 2D6)		 1dm3 BIOSYNTHETIC
THIOLASE ACETYLATED
AT CYS89
(Zoogloea
ramigera) 		5 / 9 LEU A 377
PHE A 319
ALA A 343
SER A 247
ALA A 246
 SCY  A  89 ( 3.8A)
ACO  A 813 (-4.4A)
None
ACO  A 813 (-3.7A)
ACO  A 813 ( 4.1A)
 1.39A 4wnuB-1dm3A:
0.0		 4wnuB-1dm3A:
22.00
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)		 6bn2 ACETYL-COA
ACETYLTRANSFERASE
(Elizabethkingia
anophelis) 		5 / 10 GLY A 114
GLY A 113
GLY A 354
SER A 355
ILE A 358
 None
None
SCY  A  88 ( 4.1A)
None
None
 0.89A 5aqfA-6bn2A:
undetectable		 5aqfA-6bn2A:
11.55
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)		 6bn2 ACETYL-COA
ACETYLTRANSFERASE
(Elizabethkingia
anophelis) 		5 / 10 GLY A 114
GLY A 113
GLY A 354
SER A 355
ILE A 358
 None
None
SCY  A  88 ( 4.1A)
None
None
 0.87A 5aqfC-6bn2A:
undetectable		 5aqfC-6bn2A:
11.55
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)		 6bn2 ACETYL-COA
ACETYLTRANSFERASE
(Elizabethkingia
anophelis) 		5 / 10 GLY A 114
GLY A 113
GLY A 354
SER A 355
ILE A 358
 None
None
SCY  A  88 ( 4.1A)
None
None
 0.88A 5aqyA-6bn2A:
undetectable		 5aqyA-6bn2A:
12.07
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.
5C0O_E_SAME301_0
(TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
TRMI)		 1dm3 BIOSYNTHETIC
THIOLASE ACETYLATED
AT CYS89
(Zoogloea
ramigera) 		5 / 12 ALA A 253
GLY A  55
GLY A 115
GLY A 354
ALA A  67
 None
None
None
SCY  A  89 ( 4.6A)
None
 1.01A 5c0oE-1dm3A:
undetectable		 5c0oE-1dm3A:
21.60
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.
5DZK_T_BEZT801_1
(ATP-DEPENDENT CLP
PROTEASE PROTEOLYTIC
SUBUNIT 2
BEZ-LEU-LEU)		 4z19 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3
(Yersinia
pestis) 		4 / 8 SER A 278
ALA A 277
HIS A 243
LEU A 142
 None
None
SCY  A 112 ( 3.7A)
None
 0.97A 5dzkF-4z19A:
undetectable
5dzkT-4z19A:
undetectable		 5dzkF-4z19A:
22.57
5dzkT-4z19A:
1.06
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.
5EEI_A_SHHA2004_1
(HDAC6 PROTEIN)		 5mg5 2,4-DIACETYLPHLOROGL
UCINOL BIOSYNTHESIS
PROTEIN PHLC
(Pseudomonas
protegens) 		5 / 12 SER C  91
HIS C 356
GLY C 353
ASP C 339
TYR C  13
 None
None
SCY  C  88 ( 4.6A)
None
None
 1.42A 5eeiA-5mg5C:
undetectable		 5eeiA-5mg5C:
12.90
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.
5EEI_B_SHHB801_1
(HDAC6 PROTEIN)		 5mg5 2,4-DIACETYLPHLOROGL
UCINOL BIOSYNTHESIS
PROTEIN PHLC
(Pseudomonas
protegens) 		5 / 12 SER C  91
HIS C 356
GLY C 353
ASP C 339
TYR C  13
 None
None
SCY  C  88 ( 4.6A)
None
None
 1.42A 5eeiB-5mg5C:
undetectable		 5eeiB-5mg5C:
12.90
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.
5FHZ_A_REAA602_1
(ALDEHYDE
DEHYDROGENASE FAMILY
1 MEMBER A3)		 4nhd 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3 PROTEIN 1
(Vibrio
cholerae) 		5 / 12 GLY A 305
LEU A 189
MET A 206
CYH A 146
THR A 145
 SCY  A 112 ( 3.8A)
COA  A 401 (-4.2A)
COA  A 401 (-3.8A)
None
None
 1.45A 5fhzA-4nhdA:
undetectable		 5fhzA-4nhdA:
21.82
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.
5L5Z_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 2p8u HYDROXYMETHYLGLUTARY
L-COA SYNTHASE,
CYTOPLASMIC
(Homo
sapiens) 		5 / 12 THR A 126
THR A 125
SER A 377
GLY A 376
ALA A 380
 None
None
SCY  A 129 ( 3.6A)
SCY  A 129 ( 3.5A)
None
 0.83A 5l5zV-2p8uA:
undetectable
5l5zb-2p8uA:
undetectable		 5l5zV-2p8uA:
17.88
5l5zb-2p8uA:
18.10
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.
5L5Z_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 2p8u HYDROXYMETHYLGLUTARY
L-COA SYNTHASE,
CYTOPLASMIC
(Homo
sapiens) 		5 / 12 THR A 126
THR A 125
SER A 377
GLY A 376
ALA A 380
 None
None
SCY  A 129 ( 3.6A)
SCY  A 129 ( 3.5A)
None
 0.83A 5l5zH-2p8uA:
undetectable
5l5zN-2p8uA:
undetectable		 5l5zH-2p8uA:
17.88
5l5zN-2p8uA:
18.10
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.
5TTF_C_SAMC1505_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
EHMT2)		 2p8u HYDROXYMETHYLGLUTARY
L-COA SYNTHASE,
CYTOPLASMIC
(Homo
sapiens) 		5 / 12 MET A  56
GLY A  57
SER A 347
TYR A 345
GLN A  53
 None
None
None
SCY  A 129 ( 4.2A)
None
 1.39A 5ttfC-2p8uA:
undetectable		 5ttfC-2p8uA:
21.84
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.
5V9I_D_SAMD1505_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
EHMT2)		 2p8u HYDROXYMETHYLGLUTARY
L-COA SYNTHASE,
CYTOPLASMIC
(Homo
sapiens) 		5 / 12 MET A  56
GLY A  57
SER A 347
TYR A 345
GLN A  53
 None
None
None
SCY  A 129 ( 4.2A)
None
 1.41A 5v9iD-2p8uA:
undetectable		 5v9iD-2p8uA:
21.84
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.
6C06_D_FI8D1404_1
(DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA')		 5w40 POPP2 PROTEIN
(Ralstonia
solanacearum) 		3 / 3 ARG A 322
LYS A 322
ARG A 416
 SCY  A 321 ( 4.0A)
SCY  A 321 ( 3.0A)
IHP  A 501 (-3.5A)
 1.30A 6c06D-5w40A:
undetectable		 6c06D-5w40A:
undetectable
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.
6DM0_B_CYZB1302_0
(GLUTAMATE RECEPTOR
2,VOLTAGE-DEPENDENT
CALCIUM CHANNEL
GAMMA-2 SUBUNIT)		 1dm3 BIOSYNTHETIC
THIOLASE ACETYLATED
AT CYS89
(Zoogloea
ramigera) 		5 / 10 SER A 296
LEU A 358
LEU A 377
ILE A 389
GLY A 373
 None
None
SCY  A  89 ( 3.8A)
None
None
 1.27A 6dm0B-1dm3A:
undetectable
6dm0C-1dm3A:
undetectable		 6dm0B-1dm3A:
12.34
6dm0C-1dm3A:
12.34
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.
6DWN_B_AQ4B602_1
(CYTOCHROME P450 1A1)		 6bn2 ACETYL-COA
ACETYLTRANSFERASE
(Elizabethkingia
anophelis) 		4 / 7 ASN A 117
GLY A 141
VAL A  87
LEU A 350
 None
None
SCY  A  88 ( 2.8A)
SCY  A  88 ( 3.9A)
 0.85A 6dwnB-6bn2A:
undetectable		 6dwnB-6bn2A:
23.96
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.
6GNG_B_QPSB601_2
(-)		 2p8u HYDROXYMETHYLGLUTARY
L-COA SYNTHASE,
CYTOPLASMIC
(Homo
sapiens) 		5 / 12 GLY A 173
GLY A 172
GLY A  93
HIS A 264
PRO A 214
 None
None
None
SCY  A 129 ( 3.7A)
None
 1.06A 6gngB-2p8uA:
undetectable		 6gngB-2p8uA:
22.81