SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2c3d'

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.
1FSL_A_NIOA145_1
(LEGHEMOGLOBIN A)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		4 / 8 PHE A  93
TYR A 229
HIS A 202
VAL A 126
 None
None
FAD  A1524 (-3.5A)
None
 0.80A 1fslA-2c3dA:
undetectable		 1fslA-2c3dA:
15.41
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.
1FSL_B_NIOB145_1
(LEGHEMOGLOBIN A)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		4 / 8 PHE A  93
TYR A 229
HIS A 202
VAL A 126
 None
None
FAD  A1524 (-3.5A)
None
 0.73A 1fslB-2c3dA:
undetectable		 1fslB-2c3dA:
15.41
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.
1ICV_B_NIOB702_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		4 / 5 PHE A 106
GLY A 443
SER A 450
THR A 437
 None
 1.38A 1icvA-2c3dA:
undetectable
1icvB-2c3dA:
undetectable		 1icvA-2c3dA:
18.32
1icvB-2c3dA:
18.32
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.
1X7P_A_SAMA301_0
(RRNA
METHYLTRANSFERASE)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		5 / 11 GLY A  55
GLY A  51
SER A 144
LEU A 148
ALA A  60
 None
FAD  A1524 ( 4.8A)
None
None
None
 0.98A 1x7pA-2c3dA:
3.9
1x7pB-2c3dA:
4.5		 1x7pA-2c3dA:
20.04
1x7pB-2c3dA:
20.04
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.
2E1Q_D_SALD5006_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		4 / 5 ARG A 462
THR A 490
LEU A 494
ALA A 515
 None
 1.47A 2e1qD-2c3dA:
undetectable		 2e1qD-2c3dA:
17.26
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.
2QXS_B_RALB600_1
(ESTROGEN RECEPTOR)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		5 / 12 THR A 505
GLU A 499
LEU A 500
ARG A 512
LEU A 481
 None
 1.10A 2qxsB-2c3dA:
undetectable		 2qxsB-2c3dA:
18.89
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.
2R2V_C_ACTC36_0
(GCN4 LEUCINE ZIPPER)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		5 / 10 TYR A 395
HIS A 392
ALA A  98
ALA A  97
SER A  94
 None
 1.03A 2r2vC-2c3dA:
undetectable
2r2vF-2c3dA:
undetectable
2r2vG-2c3dA:
undetectable		 2r2vC-2c3dA:
4.88
2r2vF-2c3dA:
4.88
2r2vG-2c3dA:
4.88
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.
2Y6R_B_CTCB1385_0
(TETX2 PROTEIN)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		4 / 8 ARG A 317
GLY A  51
PRO A  83
MET A 361
 FAD  A1524 ( 4.8A)
FAD  A1524 ( 4.8A)
COM  A1525 ( 4.2A)
FAD  A1524 ( 3.6A)
 0.95A 2y6rB-2c3dA:
8.8		 2y6rB-2c3dA:
23.15
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.
3AI8_B_HNQB255_1
(CATHEPSIN B)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		4 / 6 GLN A 268
GLY A 269
HIS A 394
CYH A 231
 None
 1.47A 3ai8B-2c3dA:
undetectable		 3ai8B-2c3dA:
21.48
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.
3FGR_B_ACTB21_0
(PUTATIVE
PHOSPHOLIPASE B-LIKE
2 40 KDA FORM)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		4 / 4 ARG A  42
ASP A  37
ASP A  40
PRO A  41
 None
 1.21A 3fgrB-2c3dA:
undetectable		 3fgrB-2c3dA:
20.75
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.
3KP6_A_SALA3002_1
(TRANSCRIPTIONAL
REGULATOR TCAR)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		5 / 8 VAL A 397
LEU A 391
VAL A 261
ARG A 258
LEU A 249
 None
 1.24A 3kp6A-2c3dA:
undetectable
3kp6B-2c3dA:
undetectable		 3kp6A-2c3dA:
15.27
3kp6B-2c3dA:
15.27
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.
3KPD_B_SAMB1000_1
(UNCHARACTERIZED
PROTEIN MJ0100)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		3 / 3 ASN A  35
ASN A   5
GLU A  38
 None
 0.94A 3kpdC-2c3dA:
undetectable		 3kpdC-2c3dA:
13.13
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.
3O14_A_NIOA300_1
(ANTI-ECFSIGMA
FACTOR, CHRR)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		4 / 7 ALA A 350
VAL A 345
VAL A 348
LEU A 180
 None
 0.70A 3o14A-2c3dA:
undetectable		 3o14A-2c3dA:
20.35
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.
3RGF_A_BAXA465_2
(CYCLIN-DEPENDENT
KINASE 8)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		4 / 7 LEU A 325
VAL A 348
VAL A 160
LEU A 341
 None
 0.97A 3rgfA-2c3dA:
undetectable		 3rgfA-2c3dA:
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.
4DF2_A_4CHA506_0
(NADPH DEHYDROGENASE)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		4 / 6 THR A 105
TYR A 440
HIS A 394
TYR A 395
 None
 1.33A 4df2A-2c3dA:
undetectable		 4df2A-2c3dA:
22.94
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.
4HTF_A_SAMA301_0
(S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		5 / 12 GLY A  50
GLY A  51
GLY A  55
LEU A 180
VAL A 166
 FAD  A1524 (-3.4A)
FAD  A1524 ( 4.8A)
None
None
None
 0.97A 4htfA-2c3dA:
3.0		 4htfA-2c3dA:
21.36
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.
4HTF_B_SAMB301_0
(S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		5 / 12 GLY A  50
GLY A  51
GLY A  55
LEU A 180
VAL A 166
 FAD  A1524 (-3.4A)
FAD  A1524 ( 4.8A)
None
None
None
 0.99A 4htfB-2c3dA:
2.3		 4htfB-2c3dA:
21.36
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.
4O7G_B_ASCB304_0
(PROBABLE
TRANSMEMBRANE
ASCORBATE
FERRIREDUCTASE 2)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		4 / 6 PHE A 233
ILE A 122
TYR A 211
PHE A 200
 None
 1.18A 4o7gB-2c3dA:
undetectable		 4o7gB-2c3dA:
19.02
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.
4ZDY_A_1YNA602_2
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		3 / 3 ALA A 226
TYR A 229
PRO A 186
 None
 0.63A 4zdyA-2c3dA:
undetectable		 4zdyA-2c3dA:
23.17
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.
5GWX_A_SAMA301_0
(GLYCINE SARCOSINE
N-METHYLTRANSFERASE)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		5 / 12 ALA A  54
GLY A  51
SER A  59
GLY A 183
LEU A 341
 FAD  A1524 (-3.4A)
FAD  A1524 ( 4.8A)
None
FAD  A1524 ( 3.7A)
None
 1.06A 5gwxA-2c3dA:
3.0		 5gwxA-2c3dA:
19.69
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.
5GWX_A_SAMA301_0
(GLYCINE SARCOSINE
N-METHYLTRANSFERASE)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		5 / 12 GLY A  51
GLY A  58
SER A  59
GLY A 183
LEU A 341
 FAD  A1524 ( 4.8A)
None
None
FAD  A1524 ( 3.7A)
None
 0.88A 5gwxA-2c3dA:
3.0		 5gwxA-2c3dA:
19.69
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.
5L0Z_A_SAMA304_0
(PROBABLE RNA
METHYLTRANSFERASE,
TRMH FAMILY)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		6 / 12 GLY A  55
GLY A  51
GLN A 143
SER A 144
LEU A 148
ALA A  60
 None
FAD  A1524 ( 4.8A)
None
None
None
None
 1.31A 5l0zA-2c3dA:
4.2		 5l0zA-2c3dA:
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.
5MRA_B_DM2B204_1
(SORCIN)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		4 / 6 PHE A  57
ARG A  56
ASP A  73
GLY A  50
 COM  A1525 (-4.4A)
COM  A1525 (-3.6A)
FAD  A1524 (-2.7A)
FAD  A1524 (-3.4A)
 1.13A 5mraA-2c3dA:
undetectable
5mraB-2c3dA:
undetectable		 5mraA-2c3dA:
15.24
5mraB-2c3dA:
15.24
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.
5NZY_A_CE3A1103_1
(DNA CROSS-LINK
REPAIR 1A PROTEIN)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		4 / 8 THR A 446
TYR A 260
VAL A 470
GLY A 471
 None
 0.82A 5nzyA-2c3dA:
undetectable		 5nzyA-2c3dA:
22.05
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.
5VW5_A_NCAA403_0
(FERREDOXIN--NADP
REDUCTASE)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		4 / 8 GLY A  58
CYH A 369
GLY A 368
ALA A 364
 None
None
None
FAD  A1524 (-3.6A)
 0.74A 5vw5A-2c3dA:
undetectable		 5vw5A-2c3dA:
20.42
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.
5VW9_A_NCAA403_0
(FERREDOXIN--NADP
REDUCTASE)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		4 / 8 GLY A  58
ALA A  60
CYH A 369
GLY A 368
 None
 0.48A 5vw9A-2c3dA:
undetectable		 5vw9A-2c3dA:
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.
5XOO_B_ADNB503_1
(GLYCOSAMINOGLYCAN
XYLOSYLKINASE)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		4 / 5 LEU A 249
VAL A 227
GLU A 228
LEU A 391
 None
 1.07A 5xooB-2c3dA:
undetectable		 5xooB-2c3dA:
9.29
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.
6AYC_A_1YNA502_2
(PROTEIN CYP51)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		4 / 7 VAL A 120
LEU A 310
PHE A  93
LEU A 205
 None
 1.18A 6aycA-2c3dA:
undetectable		 6aycA-2c3dA:
9.90
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.
6BRD_C_RFPC502_1
(RIFAMPIN
MONOOXYGENASE)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		5 / 12 VAL A 126
VAL A 206
GLY A 311
VAL A 220
GLY A 198
 None
 1.04A 6brdC-2c3dA:
8.4		 6brdC-2c3dA:
10.34
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.
6DWD_C_GLYC713_0
(DEOXYNUCLEOSIDE
TRIPHOSPHATE
TRIPHOSPHOHYDROLASE
SAMHD1)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		3 / 3 GLN A 342
TYR A 340
ASN A 374
 None
 1.02A 6dwdC-2c3dA:
undetectable		 6dwdC-2c3dA:
22.22
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.
6GIQ_A_CUA601_0
(CYTOCHROME C OXIDASE
SUBUNIT 1)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		3 / 3 HIS A 392
HIS A  91
HIS A  90
 None
FAD  A1524 (-4.3A)
FAD  A1524 (-4.2A)
 0.59A 6giqa-2c3dA:
undetectable		 6giqa-2c3dA:
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.
6IBL_B_H98B501_0
(THIOREDOXIN 1,BETA-1
ADRENERGIC RECEPTOR)		 2c3d 2-OXOPROPYL-COM
REDUCTASE
(Xanthobacter
autotrophicus) 		5 / 12 THR A 204
VAL A 206
VAL A 126
PHE A 233
VAL A 308
 None
 1.34A 6iblB-2c3dA:
undetectable		 6iblB-2c3dA:
21.99