SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3mwc'

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.
1FB7_A_ROCA100_1
(HIV-1 PROTEASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		5 / 12 GLY A 310
ALA A 336
ASP A 337
VAL A 363
ILE A 149
 None
 1.01A 1fb7A-3mwcA:
undetectable		 1fb7A-3mwcA:
12.75
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.
1HSG_B_MK1B902_2
(HIV-1 PROTEASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		5 / 12 GLY A 310
ALA A 336
ASP A 337
VAL A 363
ILE A 149
 None
 1.05A 1hsgB-3mwcA:
undetectable		 1hsgB-3mwcA:
12.75
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.
1SDU_B_MK1B902_2
(PROTEASE RETROPEPSIN)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		5 / 12 GLY A 310
ALA A 336
ASP A 337
VAL A 363
ILE A 149
 None
 1.06A 1sduB-3mwcA:
undetectable		 1sduB-3mwcA:
15.22
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.
2AQU_B_DR7B300_1
(HIV-1 PROTEASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		5 / 10 GLY A 310
ALA A 336
PRO A 364
VAL A 363
ILE A 149
 None
 0.99A 2aquA-3mwcA:
undetectable		 2aquA-3mwcA:
12.75
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.
2AVV_A_MK1A901_3
(POL POLYPROTEIN)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		6 / 12 GLY A 310
ALA A 336
ASP A 337
ILE A 285
VAL A 363
ILE A 149
 None
 1.22A 2avvB-3mwcA:
undetectable		 2avvB-3mwcA:
15.79
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.
2B60_B_RITB100_2
(GAG-POL POLYPROTEIN)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		5 / 11 GLY A 310
ALA A 336
ASP A 337
ILE A 361
ILE A 149
 None
 1.02A 2b60B-3mwcA:
undetectable		 2b60B-3mwcA:
13.00
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.
2HS1_A_017A201_1
(HIV-1 PROTEASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		5 / 12 GLY A 310
ALA A 336
ASP A 337
ILE A 361
ILE A 149
 None
 0.98A 2hs1A-3mwcA:
undetectable		 2hs1A-3mwcA:
15.79
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.
2HS2_A_017A201_2
(PROTEASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		5 / 12 GLY A 310
ALA A 336
ASP A 337
VAL A 363
ILE A 149
 None
 1.04A 2hs2B-3mwcA:
undetectable		 2hs2B-3mwcA:
14.44
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_B_SAMB303_0
(RIBOSOMAL PROTEIN
L11
METHYLTRANSFERASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		5 / 12 GLY A 290
GLY A  50
GLY A 108
LEU A 318
LEU A 351
 None
 0.96A 2nxeB-3mwcA:
2.1		 2nxeB-3mwcA:
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.
2NYR_B_SVRB401_3
(NAD-DEPENDENT
DEACETYLASE
SIRTUIN-5)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		5 / 12 ILE A 253
HIS A 234
PHE A 215
LEU A 207
VAL A 191
 None
 1.39A 2nyrB-3mwcA:
undetectable		 2nyrB-3mwcA:
21.27
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.
2QHC_B_AB1B9001_2
(PROTEASE RETROPEPSIN)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		5 / 12 GLY A 310
ALA A 336
ASP A 337
VAL A 363
ILE A 149
 None
 1.03A 2qhcB-3mwcA:
undetectable		 2qhcB-3mwcA:
13.17
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.
2R5Q_B_1UNB900_2
(PROTEASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		6 / 11 GLY A 310
ALA A 336
ASP A 337
ILE A 285
VAL A 363
ILE A 149
 None
 1.20A 2r5qB-3mwcA:
undetectable		 2r5qB-3mwcA:
14.52
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.
2TSR_D_D16D609_1
(THYMIDYLATE SYNTHASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		5 / 9 ILE A   8
ASP A 115
LEU A 116
PHE A  91
THR A   3
 None
 1.46A 2tsrD-3mwcA:
undetectable		 2tsrD-3mwcA:
21.65
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.
3CYX_A_ROCA201_1
(HIV-1 PROTEASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		5 / 12 GLY A 310
ALA A 336
ASP A 337
VAL A 363
ILE A 149
 None
 1.00A 3cyxA-3mwcA:
undetectable		 3cyxA-3mwcA:
14.70
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.
3D1X_A_ROCA201_1
(HIV-1 PROTEASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		6 / 12 GLY A 310
ALA A 336
ASP A 337
PRO A 364
VAL A 363
ILE A 149
 None
 1.07A 3d1xA-3mwcA:
undetectable		 3d1xA-3mwcA:
14.44
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.
3D1Y_A_ROCA201_1
(HIV-1 PROTEASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		6 / 12 GLY A 310
ALA A 336
ASP A 337
PRO A 364
VAL A 363
ILE A 149
 None
 1.11A 3d1yA-3mwcA:
undetectable		 3d1yA-3mwcA:
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.
3EL1_A_DR7A100_1
(PROTEASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		5 / 11 GLY A 310
ALA A 336
ASP A 337
VAL A 363
ILE A 149
 None
 1.03A 3el1A-3mwcA:
undetectable		 3el1A-3mwcA:
16.15
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.
3EL1_A_DR7A100_2
(PROTEASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		6 / 12 GLY A 310
ALA A 336
ASP A 337
PRO A 364
VAL A 363
ILE A 149
 None
 1.18A 3el1B-3mwcA:
undetectable		 3el1B-3mwcA:
16.15
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.
3EM4_A_DR7A100_1
(PROTEASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		5 / 11 GLY A 310
ALA A 336
ASP A 337
VAL A 363
ILE A 149
 None
 0.95A 3em4A-3mwcA:
undetectable		 3em4A-3mwcA:
16.15
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.
3K4V_D_ROCD201_3
(HIV-1 PROTEASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		5 / 12 GLY A 310
ALA A 336
ASP A 337
VAL A 363
ILE A 149
 None
 0.99A 3k4vD-3mwcA:
undetectable		 3k4vD-3mwcA:
15.79
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.
3N8X_B_NIMB1701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		5 / 12 LEU A 174
PHE A 205
ILE A 181
GLY A 152
ALA A 153
 None
 1.09A 3n8xB-3mwcA:
undetectable		 3n8xB-3mwcA:
20.18
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.
3NDT_A_ROCA101_1
(PROTEASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		6 / 12 GLY A 310
ALA A 336
ASP A 337
PRO A 364
VAL A 363
ILE A 149
 None
 1.07A 3ndtA-3mwcA:
undetectable		 3ndtA-3mwcA:
14.25
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.
3NDW_A_RITA100_1
(PROTEASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		6 / 12 GLY A 310
ALA A 336
ASP A 337
PRO A 364
VAL A 363
ILE A 149
 None
 1.10A 3ndwA-3mwcA:
undetectable		 3ndwA-3mwcA:
15.79
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.
3NDX_A_RITA100_1
(PROTEASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		6 / 12 GLY A 310
ALA A 336
ASP A 337
PRO A 364
VAL A 363
ILE A 149
 None
 1.09A 3ndxA-3mwcA:
undetectable		 3ndxA-3mwcA:
15.79
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.
3OXC_A_ROCA401_1
(PROTEASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		6 / 12 GLY A 310
ALA A 336
ASP A 337
PRO A 364
VAL A 363
ILE A 149
 None
 1.08A 3oxcA-3mwcA:
undetectable		 3oxcA-3mwcA:
15.79
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.
3OXV_A_478A200_1
(HIV-1 PROTEASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		4 / 6 GLU A 251
TRP A 220
ARG A 252
GLY A 250
 None
 1.27A 3oxvA-3mwcA:
undetectable		 3oxvA-3mwcA:
16.15
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.
3OXX_C_DR7C100_1
(HIV-1 PROTEASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		5 / 12 GLY A 310
ALA A 336
ASP A 337
VAL A 363
ILE A 149
 None
 1.02A 3oxxC-3mwcA:
undetectable		 3oxxC-3mwcA:
15.86
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.
3P2K_A_SAMA6735_1
(16S RRNA METHYLASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		3 / 3 ASP A 337
GLU A 261
SER A 173
 None
MG  A 400 ( 4.0A)
None
 0.67A 3p2kA-3mwcA:
undetectable		 3p2kA-3mwcA:
21.57
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.
3PFG_A_SAMA264_1
(N-METHYLTRANSFERASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		3 / 3 TYR A  14
TYR A  49
GLU A 387
 None
 0.98A 3pfgA-3mwcA:
undetectable		 3pfgA-3mwcA:
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.
3PWR_A_ROCA401_1
(PROTEASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		5 / 12 GLY A 310
ALA A 336
ASP A 337
VAL A 363
ILE A 149
 None
 0.97A 3pwrA-3mwcA:
undetectable		 3pwrA-3mwcA:
15.79
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.
3TKG_C_ROCC901_1
(PROTEASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		5 / 12 GLY A 310
ALA A 336
ASP A 337
VAL A 363
ILE A 149
 None
 0.99A 3tkgC-3mwcA:
undetectable		 3tkgC-3mwcA:
16.33
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.
3TKW_B_017B401_1
(PROTEASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		5 / 12 GLY A 310
ALA A 336
ASP A 337
VAL A 363
ILE A 149
 None
 0.99A 3tkwA-3mwcA:
undetectable		 3tkwA-3mwcA:
16.33
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.
3TL9_A_ROCA401_1
(PROTEASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		6 / 12 GLY A 310
ALA A 336
ASP A 337
PRO A 364
VAL A 363
ILE A 149
 None
 1.14A 3tl9A-3mwcA:
undetectable		 3tl9A-3mwcA:
16.33
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.
3W67_D_VIVD301_0
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		5 / 12 VAL A 109
SER A  52
LEU A  37
ILE A  99
ILE A  71
 None
 1.34A 3w67D-3mwcA:
1.0		 3w67D-3mwcA:
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.
4HLA_A_017A200_1
(PROTEASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		5 / 12 GLY A 310
ALA A 336
ASP A 337
VAL A 363
ILE A 149
 None
 1.03A 4hlaA-3mwcA:
undetectable		 4hlaA-3mwcA:
12.75
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.
4PEV_B_ADNB501_2
(MEMBRANE LIPOPROTEIN
FAMILY PROTEIN)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		3 / 3 PRO A 237
LEU A 238
GLN A 219
 None
 0.68A 4pevB-3mwcA:
3.1		 4pevB-3mwcA:
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.
4R87_H_SPMH202_1
(SPERMIDINE
N1-ACETYLTRANSFERASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		4 / 6 ASN A 212
GLU A 235
TYR A 240
GLU A 261
 None
MG  A 400 (-2.8A)
None
MG  A 400 ( 4.0A)
 1.46A 4r87H-3mwcA:
1.6		 4r87H-3mwcA:
21.65
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.
4S0V_A_SUVA2001_2
(HUMAN OREXIN
RECEPTOR TYPE 2
FUSION PROTEIN TO P.
ABYSII GLYCOGEN
SYNTHASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		4 / 5 ILE A 163
PRO A 193
HIS A 234
VAL A 201
 None
 1.31A 4s0vA-3mwcA:
undetectable		 4s0vA-3mwcA:
21.67
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.
4YB6_C_HISC302_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		5 / 10 GLY A 108
VAL A 109
THR A  68
VAL A  39
LEU A  77
 None
 1.36A 4yb6C-3mwcA:
undetectable
4yb6F-3mwcA:
undetectable		 4yb6C-3mwcA:
23.61
4yb6F-3mwcA:
23.61
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.
4YB6_D_HISD302_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		5 / 10 LEU A  77
GLY A 108
VAL A 109
THR A  68
VAL A  39
 None
 1.34A 4yb6A-3mwcA:
undetectable
4yb6D-3mwcA:
undetectable		 4yb6A-3mwcA:
23.61
4yb6D-3mwcA:
23.61
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.
4YB6_E_HISE302_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		5 / 10 LEU A  77
GLY A 108
VAL A 109
THR A  68
VAL A  39
 None
 1.35A 4yb6D-3mwcA:
undetectable
4yb6E-3mwcA:
undetectable		 4yb6D-3mwcA:
23.61
4yb6E-3mwcA:
23.61
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.
4Z4F_A_IPHA902_0
(PROTEIN ARGONAUTE-2)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		4 / 7 LEU A 249
PRO A 237
LEU A 217
GLU A 216
 None
 0.79A 4z4fA-3mwcA:
undetectable		 4z4fA-3mwcA:
19.86
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.
5B2S_A_ACTA107_0
(CRISPR-ASSOCIATED
ENDONUCLEASE CAS9
GUIDE RNA)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		3 / 3 VAL A  17
THR A  33
ARG A  35
 None
 0.77A 5b2sB-3mwcA:
undetectable		 5b2sB-3mwcA:
15.28
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.
5B2T_A_ACTA108_0
(CRISPR-ASSOCIATED
ENDONUCLEASE CAS9
GUIDE RNA)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		3 / 3 VAL A  17
THR A  33
ARG A  35
 None
 0.76A 5b2tB-3mwcA:
3.2		 5b2tB-3mwcA:
15.35
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.
5BW4_B_SAMB301_1
(16S RRNA
(ADENINE(1408)-N(1))
-METHYLTRANSFERASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		3 / 3 ASP A 337
GLU A 261
SER A 173
 None
MG  A 400 ( 4.0A)
None
 0.74A 5bw4B-3mwcA:
undetectable		 5bw4B-3mwcA:
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.
5KQX_A_ROCA101_1
(PROTEASE E35D-SQV)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		6 / 12 GLY A 310
ALA A 336
ASP A 337
PRO A 364
VAL A 363
ILE A 149
 None
 1.11A 5kqxA-3mwcA:
undetectable		 5kqxA-3mwcA:
15.79
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.
5T7B_A_IPHA902_0
(PROTEIN ARGONAUTE-2)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		4 / 7 LEU A 249
PRO A 237
LEU A 217
GLU A 216
 None
 0.82A 5t7bA-3mwcA:
undetectable		 5t7bA-3mwcA:
19.30
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.
5TE8_A_08JA602_1
(CYTOCHROME P450 3A4)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		4 / 7 ARG A 287
ALA A 269
ILE A 277
LEU A 243
 None
 1.03A 5te8A-3mwcA:
undetectable		 5te8A-3mwcA:
22.55
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.
5VLM_F_CVIF301_0
(REGULATORY PROTEIN
TETR)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		5 / 12 GLY A 108
SER A  52
GLU A  51
ASP A 115
PHE A 322
 None
 1.41A 5vlmF-3mwcA:
undetectable		 5vlmF-3mwcA:
19.79
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_D_AQ4D602_0
(CYTOCHROME P450 1A1)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		5 / 12 ILE A 129
GLY A 368
ALA A 369
PHE A 371
ILE A 285
 None
 1.06A 6dwnD-3mwcA:
undetectable		 6dwnD-3mwcA:
11.68
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.
6MA7_A_TPFA602_0
(CYTOCHROME P450 3A4)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		4 / 7 ARG A  34
ALA A 340
ILE A 324
ALA A 320
 None
 0.90A 6ma7A-3mwcA:
undetectable		 6ma7A-3mwcA:
11.83
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.
6MN5_F_LLLF301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		4 / 5 TYR A  60
GLU A 261
ASP A 260
CYH A 258
 None
MG  A 400 ( 4.0A)
MG  A 400 (-3.1A)
None
 1.37A 6mn5F-3mwcA:
0.0		 6mn5F-3mwcA:
13.04
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.
6R2E_F_FFOF403_0
(THYMIDYLATE SYNTHASE)		 3mwc MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN
(Kosmotoga
olearia) 		5 / 11 ILE A 117
LEU A 125
GLY A 368
MET A 128
ALA A 127
 None
 1.32A 6r2eF-3mwcA:
undetectable		 6r2eF-3mwcA:
23.00