SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2a87'

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.
1T6Z_A_RBFA296_1
(RIBOFLAVIN
KINASE/FMN
ADENYLYLTRANSFERASE)		 2a87 THIOREDOXIN
REDUCTASE
(Mycobacterium
tuberculosis) 		5 / 11 VAL A  93
VAL A  96
GLU A  91
LEU A  41
ILE A  18
 FAD  A 348 (-4.1A)
None
None
None
None
 0.76A 1t6zA-2a87A:
undetectable		 1t6zA-2a87A:
22.99
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.
2ACL_E_REAE504_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 2a87 THIOREDOXIN
REDUCTASE
(Mycobacterium
tuberculosis) 		5 / 11 ILE A 309
ALA A 308
ALA A 311
LEU A 315
ALA A  33
 None
 1.10A 2aclE-2a87A:
undetectable		 2aclE-2a87A:
23.01
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.
2G72_B_SAMB2002_0
(PHENYLETHANOLAMINE
N-METHYLTRANSFERASE)		 2a87 THIOREDOXIN
REDUCTASE
(Mycobacterium
tuberculosis) 		5 / 12 THR A 238
ILE A 161
VAL A 246
ALA A 216
VAL A 142
 None
 1.12A 2g72B-2a87A:
undetectable		 2g72B-2a87A:
22.79
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.
2HA4_A_ACTA544_0
(ACETYLCHOLINESTERASE)		 2a87 THIOREDOXIN
REDUCTASE
(Mycobacterium
tuberculosis) 		5 / 8 GLY A 162
GLY A 163
ALA A 167
PHE A 208
PHE A 190
 NAP  A 381 ( 3.9A)
NAP  A 381 ( 4.7A)
None
None
None
 1.14A 2ha4A-2a87A:
undetectable		 2ha4A-2a87A:
22.02
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.
2UXP_B_CLMB1211_0
(HTH-TYPE
TRANSCRIPTIONAL
REGULATOR TTGR)		 2a87 THIOREDOXIN
REDUCTASE
(Mycobacterium
tuberculosis) 		5 / 11 ALA A 286
VAL A 269
GLY A  21
ILE A  20
VAL A 257
 None
None
FAD  A 348 (-3.1A)
None
None
 1.22A 2uxpB-2a87A:
undetectable		 2uxpB-2a87A:
23.77
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.
2ZM9_A_ACAA502_1
(6-AMINOHEXANOATE-DIM
ER HYDROLASE)		 2a87 THIOREDOXIN
REDUCTASE
(Mycobacterium
tuberculosis) 		4 / 8 MET A 122
ALA A 121
GLY A  21
ILE A  20
 None
None
FAD  A 348 (-3.1A)
None
 0.82A 2zm9A-2a87A:
undetectable		 2zm9A-2a87A:
24.89
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.
3D2T_A_1FLA502_1
(TRANSTHYRETIN)		 2a87 THIOREDOXIN
REDUCTASE
(Mycobacterium
tuberculosis) 		4 / 7 ALA A 159
SER A 180
THR A 182
VAL A 184
 None
 0.82A 3d2tA-2a87A:
undetectable		 3d2tA-2a87A:
16.29
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.
3D2T_B_1FLB500_1
(TRANSTHYRETIN)		 2a87 THIOREDOXIN
REDUCTASE
(Mycobacterium
tuberculosis) 		4 / 6 ALA A 159
SER A 180
THR A 182
VAL A 184
 None
 0.76A 3d2tB-2a87A:
undetectable		 3d2tB-2a87A:
16.29
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.
3KU1_C_SAMC226_0
(SAM-DEPENDENT
METHYLTRANSFERASE)		 2a87 THIOREDOXIN
REDUCTASE
(Mycobacterium
tuberculosis) 		5 / 12 GLY A 287
ASP A 291
ALA A 301
GLY A 302
ILE A 119
 FAD  A 348 (-3.2A)
None
None
None
None
 0.91A 3ku1C-2a87A:
5.0		 3ku1C-2a87A:
23.53
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.
3M6V_A_SAMA465_0
(RRNA METHYLASE)		 2a87 THIOREDOXIN
REDUCTASE
(Mycobacterium
tuberculosis) 		5 / 12 ALA A 121
GLY A  50
GLY A  49
VAL A 290
ASP A 291
 None
FAD  A 348 (-2.8A)
FAD  A 348 (-3.9A)
None
None
 0.93A 3m6vA-2a87A:
undetectable		 3m6vA-2a87A:
22.71
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.
3M6V_A_SAMA465_0
(RRNA METHYLASE)		 2a87 THIOREDOXIN
REDUCTASE
(Mycobacterium
tuberculosis) 		5 / 12 ALA A 286
PRO A  24
GLY A  23
VAL A 290
ASP A 291
 None
FAD  A 348 (-3.7A)
FAD  A 348 (-3.4A)
None
None
 1.10A 3m6vA-2a87A:
undetectable		 3m6vA-2a87A:
22.71
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.
3M6V_B_SAMB465_0
(RRNA METHYLASE)		 2a87 THIOREDOXIN
REDUCTASE
(Mycobacterium
tuberculosis) 		5 / 12 ALA A 121
GLY A  50
GLY A  49
VAL A 290
ASP A 291
 None
FAD  A 348 (-2.8A)
FAD  A 348 (-3.9A)
None
None
 0.93A 3m6vB-2a87A:
2.5		 3m6vB-2a87A:
22.71
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.
3M6V_B_SAMB465_0
(RRNA METHYLASE)		 2a87 THIOREDOXIN
REDUCTASE
(Mycobacterium
tuberculosis) 		5 / 12 ALA A 286
PRO A  24
GLY A  23
VAL A 290
ASP A 291
 None
FAD  A 348 (-3.7A)
FAD  A 348 (-3.4A)
None
None
 1.09A 3m6vB-2a87A:
2.5		 3m6vB-2a87A:
22.71
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.
3M6W_A_SAMA465_0
(RRNA METHYLASE)		 2a87 THIOREDOXIN
REDUCTASE
(Mycobacterium
tuberculosis) 		5 / 12 ALA A 121
GLY A  50
GLY A  49
VAL A 290
ASP A 291
 None
FAD  A 348 (-2.8A)
FAD  A 348 (-3.9A)
None
None
 0.94A 3m6wA-2a87A:
2.4		 3m6wA-2a87A:
22.71
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.
4KRH_A_SAMA900_0
(PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE
2)		 2a87 THIOREDOXIN
REDUCTASE
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  85
LEU A  38
ALA A 308
ARG A  78
ILE A 119
 None
 0.94A 4krhA-2a87A:
undetectable		 4krhA-2a87A:
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.
4KRH_B_SAMB900_0
(PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE
2)		 2a87 THIOREDOXIN
REDUCTASE
(Mycobacterium
tuberculosis) 		5 / 12 GLY A  85
LEU A  38
ALA A 308
ARG A  78
ILE A 119
 None
 0.99A 4krhB-2a87A:
undetectable		 4krhB-2a87A:
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.
4ZJZ_A_BEZA1001_0
(BENZOATE-COENZYME A
LIGASE)		 2a87 THIOREDOXIN
REDUCTASE
(Mycobacterium
tuberculosis) 		4 / 8 ALA A 286
GLY A 304
ALA A  29
GLY A  26
 None
 0.69A 4zjzA-2a87A:
undetectable		 4zjzA-2a87A:
23.51
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.
5ENT_C_MIYC901_1
(MULTIDRUG EFFLUX
PUMP SUBUNIT
ACRB,MULTIDRUG
EFFLUX PUMP SUBUNIT
ACRB)		 2a87 THIOREDOXIN
REDUCTASE
(Mycobacterium
tuberculosis) 		5 / 9 GLY A  26
SER A  22
GLU A  44
ILE A 119
ALA A 286
 None
FAD  A 348 (-3.8A)
None
None
None
 1.07A 5entC-2a87A:
undetectable		 5entC-2a87A:
20.68
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.
5JM4_B_BEZB301_0
(14-3-3 PROTEIN
ZETA/DELTA)		 2a87 THIOREDOXIN
REDUCTASE
(Mycobacterium
tuberculosis) 		4 / 4 PHE A  43
ILE A  18
GLN A 111
ARG A  89
 None
 1.07A 5jm4B-2a87A:
1.0		 5jm4B-2a87A:
21.78
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.
5LF3_H_BO2H306_1
(PROTEASOME SUBUNIT
BETA TYPE-7
PROTEASOME SUBUNIT
BETA TYPE-3)		 2a87 THIOREDOXIN
REDUCTASE
(Mycobacterium
tuberculosis) 		5 / 10 ALA A 307
THR A 276
ALA A 300
GLY A 287
ALA A 121
 None
None
FAD  A 348 ( 3.7A)
FAD  A 348 (-3.2A)
None
 1.19A 5lf3H-2a87A:
undetectable
5lf3I-2a87A:
undetectable		 5lf3H-2a87A:
24.08
5lf3I-2a87A:
21.24
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.
5LF3_V_BO2V303_1
(PROTEASOME SUBUNIT
BETA TYPE-7
PROTEASOME SUBUNIT
BETA TYPE-3)		 2a87 THIOREDOXIN
REDUCTASE
(Mycobacterium
tuberculosis) 		5 / 10 ALA A 307
THR A 276
ALA A 300
GLY A 287
ALA A 121
 None
None
FAD  A 348 ( 3.7A)
FAD  A 348 (-3.2A)
None
 1.18A 5lf3V-2a87A:
undetectable
5lf3W-2a87A:
undetectable		 5lf3V-2a87A:
24.08
5lf3W-2a87A:
21.24
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.
5ODI_D_ACTD202_0
(METHYL-VIOLOGEN
REDUCING
HYDROGENASE, SUBUNIT
D)		 2a87 THIOREDOXIN
REDUCTASE
(Mycobacterium
tuberculosis) 		3 / 3 HIS A 318
GLU A 317
TRP A 314
 None
 0.92A 5odiD-2a87A:
3.7		 5odiD-2a87A:
17.48
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.
5ODQ_D_ACTD202_0
(METHYL-VIOLOGEN
REDUCING
HYDROGENASE, SUBUNIT
D)		 2a87 THIOREDOXIN
REDUCTASE
(Mycobacterium
tuberculosis) 		3 / 3 HIS A 318
GLU A 317
TRP A 314
 None
 0.93A 5odqD-2a87A:
2.6		 5odqD-2a87A:
17.48
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.
5ODR_D_ACTD202_0
(METHYL-VIOLOGEN
REDUCING
HYDROGENASE, SUBUNIT
D)		 2a87 THIOREDOXIN
REDUCTASE
(Mycobacterium
tuberculosis) 		3 / 3 HIS A 318
GLU A 317
TRP A 314
 None
 0.90A 5odrD-2a87A:
3.8		 5odrD-2a87A:
17.48
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.
5UUN_A_ACTA309_0
(GLUTATHIONE
S-TRANSFERASE-LIKE
PROTEIN)		 2a87 THIOREDOXIN
REDUCTASE
(Mycobacterium
tuberculosis) 		4 / 4 LEU A 138
GLY A 139
SER A 143
SER A 144
 None
None
None
FAD  A 348 ( 4.6A)
 0.81A 5uunA-2a87A:
undetectable		 5uunA-2a87A:
22.06
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.
5UUN_B_ACTB306_0
(GLUTATHIONE
S-TRANSFERASE-LIKE
PROTEIN)		 2a87 THIOREDOXIN
REDUCTASE
(Mycobacterium
tuberculosis) 		4 / 4 LEU A 138
GLY A 139
SER A 143
SER A 144
 None
None
None
FAD  A 348 ( 4.6A)
 0.81A 5uunB-2a87A:
undetectable		 5uunB-2a87A:
22.06
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.
5X7Z_A_BHAA201_0
(UNCHARACTERIZED
HTH-TYPE
TRANSCRIPTIONAL
REGULATOR RV2887)		 2a87 THIOREDOXIN
REDUCTASE
(Mycobacterium
tuberculosis) 		4 / 6 LEU A 256
VAL A  96
LEU A  98
VAL A 105
 FAD  A 348 (-4.7A)
None
None
None
 0.93A 5x7zA-2a87A:
undetectable		 5x7zA-2a87A:
23.28
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.
5ZNI_A_YMZA302_0
(PURINE NUCLEOSIDE
PHOSPHORYLASE)		 2a87 THIOREDOXIN
REDUCTASE
(Mycobacterium
tuberculosis) 		5 / 9 VAL A 181
GLY A 141
VAL A 223
ASP A 149
GLY A 139
 None
None
None
FAD  A 348 (-3.4A)
None
 1.21A 5zniA-2a87A:
undetectable		 5zniA-2a87A:
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.
5ZW4_A_SAMA302_0
(PUTATIVE
O-METHYLTRANSFERASE
YRRM)		 2a87 THIOREDOXIN
REDUCTASE
(Mycobacterium
tuberculosis) 		5 / 12 ILE A 119
GLY A 287
ALA A 121
ALA A 300
ALA A 297
 None
FAD  A 348 (-3.2A)
None
FAD  A 348 ( 3.7A)
FAD  A 348 (-3.2A)
 1.03A 5zw4A-2a87A:
3.1		 5zw4A-2a87A:
21.43