SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3c87'

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.
1AV2_D_DVAD8_0
(GRAMICIDIN A)		 3c87 ENTEROCHELIN
ESTERASE
(Shigella
flexneri) 		3 / 3 VAL A  51
VAL A  49
TRP A  79
 None
 0.80A 1av2C-3c87A:
undetectable
1av2D-3c87A:
undetectable		 1av2C-3c87A:
3.61
1av2D-3c87A:
3.61
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.
1L4N_A_NIOA991_1
(NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 3c87 ENTEROCHELIN
ESTERASE
(Shigella
flexneri) 		5 / 9 GLY A 383
GLY A 342
SER A 305
GLU A 340
GLY A 373
 None
 1.33A 1l4nA-3c87A:
undetectable		 1l4nA-3c87A:
22.58
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.
1L5L_A_NIOA991_1
(NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 3c87 ENTEROCHELIN
ESTERASE
(Shigella
flexneri) 		5 / 9 GLY A 383
GLY A 342
SER A 305
GLU A 340
GLY A 373
 None
 1.31A 1l5lA-3c87A:
undetectable		 1l5lA-3c87A:
22.58
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.
1L5M_A_NIOA991_1
(NICOTINATE-NUCLEOTID
E--DIMETHYLBENZIMIDA
ZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 3c87 ENTEROCHELIN
ESTERASE
(Shigella
flexneri) 		5 / 9 GLY A 383
GLY A 342
SER A 305
GLU A 340
GLY A 373
 None
 1.30A 1l5mA-3c87A:
undetectable		 1l5mA-3c87A:
22.58
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.
1QKN_A_RALA600_1
(ESTROGEN RECEPTOR
BETA)		 3c87 ENTEROCHELIN
ESTERASE
(Shigella
flexneri) 		5 / 12 LEU A 258
ALA A 253
LEU A 175
ILE A 168
ILE A 169
 None
 0.97A 1qknA-3c87A:
undetectable		 1qknA-3c87A:
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.
1QZZ_A_ACTA421_0
(ACLACINOMYCIN-10-HYD
ROXYLASE)		 3c87 ENTEROCHELIN
ESTERASE
(Shigella
flexneri) 		4 / 8 GLY A 387
GLY A 383
GLY A 382
LEU A 384
 None
 0.66A 1qzzA-3c87A:
undetectable		 1qzzA-3c87A:
21.99
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.
1S9P_A_DESA459_1
(ESTROGEN-RELATED
RECEPTOR GAMMA)		 3c87 ENTEROCHELIN
ESTERASE
(Shigella
flexneri) 		5 / 12 LEU A 218
LEU A 224
ALA A 227
VAL A 276
LEU A 384
 None
 1.07A 1s9pA-3c87A:
undetectable		 1s9pA-3c87A:
19.35
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.
1S9P_D_DESD600_1
(ESTROGEN-RELATED
RECEPTOR GAMMA)		 3c87 ENTEROCHELIN
ESTERASE
(Shigella
flexneri) 		5 / 12 LEU A 218
LEU A 224
ALA A 227
VAL A 276
LEU A 384
 None
 1.10A 1s9pD-3c87A:
undetectable		 1s9pD-3c87A:
19.35
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.
1W5U_D_DVAD8_0
(GRAMICIDIN D)		 3c87 ENTEROCHELIN
ESTERASE
(Shigella
flexneri) 		3 / 3 VAL A  51
VAL A  49
TRP A  79
 None
 0.86A 1w5uC-3c87A:
undetectable
1w5uD-3c87A:
undetectable		 1w5uC-3c87A:
3.61
1w5uD-3c87A:
3.61
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.
2BR4_B_SAMB301_1
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 3c87 ENTEROCHELIN
ESTERASE
(Shigella
flexneri) 		4 / 4 LEU A 137
SER A 307
ASP A 201
ASP A 233
 None
 1.13A 2br4B-3c87A:
2.9		 2br4B-3c87A:
19.60
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.
2F8D_A_BEZA1001_0
(HTH-TYPE
TRANSCRIPTIONAL
REGULATOR BENM)		 3c87 ENTEROCHELIN
ESTERASE
(Shigella
flexneri) 		4 / 6 VAL A 141
SER A  90
LEU A 137
HIS A 375
 None
 1.26A 2f8dA-3c87A:
undetectable		 2f8dA-3c87A:
19.26
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.
2G70_B_SAMB2002_1
(PHENYLETHANOLAMINE
N-METHYLTRANSFERASE)		 3c87 ENTEROCHELIN
ESTERASE
(Shigella
flexneri) 		4 / 7 TYR A 229
GLY A 187
THR A 186
ASP A 188
 None
 1.07A 2g70B-3c87A:
undetectable		 2g70B-3c87A:
20.99
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.
2NXE_A_SAMA302_0
(RIBOSOMAL PROTEIN
L11
METHYLTRANSFERASE)		 3c87 ENTEROCHELIN
ESTERASE
(Shigella
flexneri) 		6 / 12 GLY A 306
ASP A 201
LEU A 199
GLY A 284
LEU A 384
LEU A 388
 None
 1.42A 2nxeA-3c87A:
undetectable		 2nxeA-3c87A:
22.64
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.
2RCT_A_RTLA140_1
(RETINOL-BINDING
PROTEIN II, CELLULAR)		 3c87 ENTEROCHELIN
ESTERASE
(Shigella
flexneri) 		3 / 3 GLN A  64
THR A  57
TRP A  79
 None
 1.14A 2rctA-3c87A:
undetectable		 2rctA-3c87A:
17.32
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.
2YA7_A_ZMRA1776_2
(NEURAMINIDASE A)		 3c87 ENTEROCHELIN
ESTERASE
(Shigella
flexneri) 		4 / 6 ASP A 233
ILE A 232
LEU A 258
GLU A 243
 None
 1.03A 2ya7A-3c87A:
undetectable		 2ya7A-3c87A:
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.
2YA7_B_ZMRB1776_2
(NEURAMINIDASE A)		 3c87 ENTEROCHELIN
ESTERASE
(Shigella
flexneri) 		4 / 6 ASP A 233
ILE A 232
LEU A 258
GLU A 243
 None
 1.02A 2ya7B-3c87A:
undetectable		 2ya7B-3c87A:
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.
2YA7_D_ZMRD1776_2
(NEURAMINIDASE A)		 3c87 ENTEROCHELIN
ESTERASE
(Shigella
flexneri) 		4 / 6 ASP A 233
ILE A 232
LEU A 258
GLU A 243
 None
 1.03A 2ya7D-3c87A:
undetectable		 2ya7D-3c87A:
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.
3E23_A_SAMA221_0
(UNCHARACTERIZED
PROTEIN RPA2492)		 3c87 ENTEROCHELIN
ESTERASE
(Shigella
flexneri) 		5 / 12 LEU A 378
PRO A 346
GLY A  55
GLY A  89
SER A  90
 None
 1.12A 3e23A-3c87A:
undetectable		 3e23A-3c87A:
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.
3L8L_D_DVAD8_0
(GRAMICIDIN D)		 3c87 ENTEROCHELIN
ESTERASE
(Shigella
flexneri) 		3 / 3 VAL A  51
VAL A  49
TRP A  79
 None
 0.94A 3l8lC-3c87A:
undetectable
3l8lD-3c87A:
undetectable		 3l8lC-3c87A:
3.61
3l8lD-3c87A:
3.61
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.
3ME6_B_CGEB501_1
(CYTOCHROME P450 2B4)		 3c87 ENTEROCHELIN
ESTERASE
(Shigella
flexneri) 		4 / 8 PHE A 184
ALA A 227
THR A 186
VAL A 211
 None
 0.91A 3me6B-3c87A:
undetectable		 3me6B-3c87A:
22.74
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.
3OZW_A_KKKA413_1
(FLAVOHEMOGLOBIN)		 3c87 ENTEROCHELIN
ESTERASE
(Shigella
flexneri) 		4 / 8 TYR A 308
ALA A 290
LEU A 292
LEU A 359
 None
 0.77A 3ozwA-3c87A:
undetectable		 3ozwA-3c87A:
21.98
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.
4DC3_B_2FAB401_1
(ADENOSINE KINASE)		 3c87 ENTEROCHELIN
ESTERASE
(Shigella
flexneri) 		5 / 12 LEU A 359
GLY A 279
GLY A 284
VAL A 301
LEU A 339
 None
 0.93A 4dc3B-3c87A:
3.4		 4dc3B-3c87A:
21.81
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.
4E7C_A_ACTA504_0
(UDP-N-ACETYLGLUCOSAM
INE
1-CARBOXYVINYLTRANSF
ERASE)		 3c87 ENTEROCHELIN
ESTERASE
(Shigella
flexneri) 		3 / 3 ARG A  35
TRP A  11
GLY A   7
 None
 0.91A 4e7cA-3c87A:
undetectable		 4e7cA-3c87A:
24.38
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.
4PWD_C_NVPC901_1
(HIV-1 REVERSE
TRANSCRIPTASE, P66
SUBUNIT)		 3c87 ENTEROCHELIN
ESTERASE
(Shigella
flexneri) 		4 / 8 LEU A 384
VAL A 276
VAL A 338
LEU A 199
 None
 1.11A 4pwdC-3c87A:
undetectable		 4pwdC-3c87A:
21.37
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.
4Z90_F_4LEF402_1
(GAMMA-AMINOBUTYRIC-A
CID RECEPTOR SUBUNIT
BETA-1)		 3c87 ENTEROCHELIN
ESTERASE
(Shigella
flexneri) 		4 / 7 LEU A 384
ALA A 278
LEU A 388
ALA A 197
 None
 0.63A 4z90F-3c87A:
3.6
4z90G-3c87A:
2.9
4z90H-3c87A:
2.9
4z90J-3c87A:
3.4		 4z90F-3c87A:
21.69
4z90G-3c87A:
21.69
4z90H-3c87A:
21.69
4z90J-3c87A:
21.69
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.
5N5D_A_SAMA306_0
(METHYLTRANSFERASE)		 3c87 ENTEROCHELIN
ESTERASE
(Shigella
flexneri) 		5 / 12 ALA A 197
VAL A 198
GLY A 299
PHE A 298
ALA A 272
 None
 1.02A 5n5dA-3c87A:
undetectable		 5n5dA-3c87A:
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.
5XU8_A_DX4A701_0
(UBIQUITIN
CARBOXYL-TERMINAL
HYDROLASE 2)		 3c87 ENTEROCHELIN
ESTERASE
(Shigella
flexneri) 		4 / 8 GLY A 283
LEU A 244
CYH A 246
ALA A 290
 None
 0.76A 5xu8A-3c87A:
undetectable		 5xu8A-3c87A:
19.90
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.
5YOD_H_BEZH201_0
(NS3 PROTEASE)		 3c87 ENTEROCHELIN
ESTERASE
(Shigella
flexneri) 		4 / 5 HIS A 375
SER A 307
TYR A 308
GLY A 306
 None
 1.25A 5yodH-3c87A:
undetectable		 5yodH-3c87A:
19.65
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.
6EFN_A_SAMA501_0
(SPORULATION KILLING
FACTOR MATURATION
PROTEIN SKFB)		 3c87 ENTEROCHELIN
ESTERASE
(Shigella
flexneri) 		5 / 11 TYR A 229
THR A 219
GLU A 162
ALA A 191
LEU A 196
 None
 1.33A 6efnA-3c87A:
undetectable		 6efnA-3c87A:
21.05