SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5w25'

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.
1HTT_C_HISC450_0
(HISTIDYL-TRNA
SYNTHETASE)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		5 / 12 GLU A 173
GLN A 233
GLY A 489
GLY A 533
ALA A 535
 ASP  A 701 (-3.2A)
ASP  A 701 (-3.3A)
ASP  A 701 ( 4.0A)
None
ASP  A 701 (-3.6A)
 0.79A 1httC-5w25A:
14.5		 1httC-5w25A:
23.00
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.
1HTT_D_HISD450_0
(HISTIDYL-TRNA
SYNTHETASE)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		5 / 12 ARG A 219
GLN A 233
GLY A 489
GLY A 533
ALA A 535
 ASP  A 701 (-3.2A)
ASP  A 701 (-3.3A)
ASP  A 701 ( 4.0A)
None
ASP  A 701 (-3.6A)
 0.44A 1httD-5w25A:
14.6		 1httD-5w25A:
23.00
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.
1HTT_D_HISD450_0
(HISTIDYL-TRNA
SYNTHETASE)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		5 / 12 GLU A 173
ARG A 227
GLN A 233
GLY A 489
ALA A 535
 ASP  A 701 (-3.2A)
None
ASP  A 701 (-3.3A)
ASP  A 701 ( 4.0A)
ASP  A 701 (-3.6A)
 1.06A 1httD-5w25A:
14.6		 1httD-5w25A:
23.00
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.
1HTT_D_HISD450_0
(HISTIDYL-TRNA
SYNTHETASE)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		5 / 12 GLU A 173
GLN A 233
GLY A 489
GLY A 533
ALA A 535
 ASP  A 701 (-3.2A)
ASP  A 701 (-3.3A)
ASP  A 701 ( 4.0A)
None
ASP  A 701 (-3.6A)
 0.88A 1httD-5w25A:
14.6		 1httD-5w25A:
23.00
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.
1MJL_B_SAMB400_0
(METHIONINE REPRESSOR
PROTEIN METJ)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		5 / 9 GLU A 500
ARG A 496
LEU A 521
GLU A 514
GLY A 507
 None
 1.45A 1mjlA-5w25A:
undetectable
1mjlB-5w25A:
undetectable		 1mjlA-5w25A:
10.52
1mjlB-5w25A:
10.52
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.
1MJQ_B_SAMB200_0
(METHIONINE REPRESSOR)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		5 / 11 GLY A 507
GLU A 500
ARG A 496
LEU A 521
GLU A 514
 None
 1.45A 1mjqA-5w25A:
undetectable
1mjqB-5w25A:
undetectable		 1mjqA-5w25A:
10.52
1mjqB-5w25A:
10.52
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.
1MJQ_H_SAMH200_0
(METHIONINE REPRESSOR)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		5 / 10 GLY A 507
GLU A 500
ARG A 496
LEU A 521
GLU A 514
 None
 1.45A 1mjqG-5w25A:
undetectable
1mjqH-5w25A:
undetectable		 1mjqG-5w25A:
10.52
1mjqH-5w25A:
10.52
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.
2UXO_B_TACB1211_1
(HTH-TYPE
TRANSCRIPTIONAL
REGULATOR TTGR)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		5 / 11 LEU A 545
VAL A 146
LEU A 154
ILE A 486
ILE A 214
 None
 1.12A 2uxoB-5w25A:
undetectable		 2uxoB-5w25A:
15.70
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.
3BJW_G_SVRG506_2
(PHOSPHOLIPASE A2)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		4 / 5 VAL A 422
VAL A 423
PHE A 419
ARG A 492
 None
None
None
ASP  A 701 (-2.9A)
 1.31A 3bjwB-5w25A:
undetectable		 3bjwB-5w25A:
11.34
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.
3CR5_X_PNTX95_0
(PROTEIN S100-B)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		3 / 3 CYH A 297
PHE A 300
PHE A 301
 None
 0.51A 3cr5X-5w25A:
undetectable		 3cr5X-5w25A:
10.20
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.
3MS9_A_STIA1_2
(TYROSINE-PROTEIN
KINASE ABL1)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		4 / 6 VAL A 146
ILE A 214
MET A 238
ARG A 540
 None
 1.12A 3ms9A-5w25A:
undetectable		 3ms9A-5w25A:
19.61
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.
3MSS_A_STIA1_2
(TYROSINE-PROTEIN
KINASE ABL1)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		4 / 6 VAL A 146
ILE A 214
MET A 238
ARG A 540
 None
 1.13A 3mssA-5w25A:
undetectable		 3mssA-5w25A:
19.61
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.
3MSS_C_STIC1_2
(TYROSINE-PROTEIN
KINASE ABL1)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		4 / 6 VAL A 146
ILE A 214
MET A 238
ARG A 540
 None
 1.11A 3mssC-5w25A:
undetectable		 3mssC-5w25A:
19.61
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.
4C49_B_HCYB1384_1
(CORTICOSTEROID-BINDI
NG GLOBULIN)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		5 / 12 SER A  72
VAL A  73
ILE A  37
PHE A  50
HIS A  63
 None
 1.48A 4c49B-5w25A:
0.9		 4c49B-5w25A:
20.00
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.
4CEV_A_GAIA407_0
(PROTEIN (ARGINASE))		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		4 / 6 ARG A 495
GLU A 500
LEU A 521
ASP A 497
 None
 1.45A 4cevA-5w25A:
undetectable
4cevB-5w25A:
undetectable		 4cevA-5w25A:
20.37
4cevB-5w25A:
20.37
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.
4WNW_A_RTZA602_1
(CYTOCHROME P450 2D6)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		5 / 12 LEU A 198
GLN A 201
SER A 195
VAL A 442
PHE A 517
 None
None
ASP  A 701 (-3.6A)
None
None
 1.11A 4wnwA-5w25A:
undetectable		 4wnwA-5w25A:
22.92
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.
4Z2E_H_TR6H101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
SYMMETRIZED E-SITE
DNA)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		3 / 5 GLY A 489
GLY A 487
GLU A 485
 ASP  A 701 ( 4.0A)
None
None
 0.49A 4z2eA-5w25A:
undetectable
4z2eD-5w25A:
undetectable		 4z2eA-5w25A:
22.02
4z2eD-5w25A:
20.16
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.
5E3I_A_HISA502_0
(HISTIDINE--TRNA
LIGASE)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		5 / 12 ARG A 219
GLN A 233
GLY A 489
GLY A 533
ALA A 535
 ASP  A 701 (-3.2A)
ASP  A 701 (-3.3A)
ASP  A 701 ( 4.0A)
None
ASP  A 701 (-3.6A)
 0.29A 5e3iA-5w25A:
14.4		 5e3iA-5w25A:
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.
5E3I_A_HISA502_0
(HISTIDINE--TRNA
LIGASE)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		5 / 12 GLU A 173
GLN A 233
GLY A 488
GLY A 489
ALA A 535
 ASP  A 701 (-3.2A)
ASP  A 701 (-3.3A)
None
ASP  A 701 ( 4.0A)
ASP  A 701 (-3.6A)
 1.13A 5e3iA-5w25A:
14.4		 5e3iA-5w25A:
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.
5E3I_A_HISA502_0
(HISTIDINE--TRNA
LIGASE)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		5 / 12 GLU A 173
GLN A 233
GLY A 489
GLY A 533
ALA A 535
 ASP  A 701 (-3.2A)
ASP  A 701 (-3.3A)
ASP  A 701 ( 4.0A)
None
ASP  A 701 (-3.6A)
 0.86A 5e3iA-5w25A:
14.4		 5e3iA-5w25A:
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.
5E3I_B_HISB502_0
(HISTIDINE--TRNA
LIGASE)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		5 / 11 ARG A 219
GLN A 233
GLY A 489
GLY A 533
ALA A 535
 ASP  A 701 (-3.2A)
ASP  A 701 (-3.3A)
ASP  A 701 ( 4.0A)
None
ASP  A 701 (-3.6A)
 0.28A 5e3iB-5w25A:
14.3		 5e3iB-5w25A:
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.
5E3I_B_HISB502_0
(HISTIDINE--TRNA
LIGASE)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		5 / 11 GLU A 173
GLN A 233
GLY A 488
GLY A 489
ALA A 535
 ASP  A 701 (-3.2A)
ASP  A 701 (-3.3A)
None
ASP  A 701 ( 4.0A)
ASP  A 701 (-3.6A)
 1.12A 5e3iB-5w25A:
14.3		 5e3iB-5w25A:
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.
5E3I_B_HISB502_0
(HISTIDINE--TRNA
LIGASE)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		5 / 11 GLU A 173
GLN A 233
GLY A 489
GLY A 533
ALA A 535
 ASP  A 701 (-3.2A)
ASP  A 701 (-3.3A)
ASP  A 701 ( 4.0A)
None
ASP  A 701 (-3.6A)
 0.86A 5e3iB-5w25A:
14.3		 5e3iB-5w25A:
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.
5N0S_A_SAMA501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		5 / 12 ILE A 534
GLY A 487
ILE A 249
MET A 236
VAL A 253
 None
 1.04A 5n0sA-5w25A:
undetectable		 5n0sA-5w25A:
21.32
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.
5N0T_A_SAMA501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		5 / 12 ILE A 534
GLY A 487
ILE A 249
MET A 236
VAL A 253
 None
 1.02A 5n0tA-5w25A:
undetectable		 5n0tA-5w25A:
21.45
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.
5N0T_B_SAMB501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		5 / 12 ILE A 534
GLY A 487
ILE A 249
MET A 236
VAL A 253
 None
 0.99A 5n0tB-5w25A:
undetectable		 5n0tB-5w25A:
21.45
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.
5N0W_B_SAMB501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		5 / 12 ILE A 534
GLY A 487
ILE A 249
MET A 236
VAL A 253
 None
 1.02A 5n0wB-5w25A:
undetectable		 5n0wB-5w25A:
21.17
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.
5N0X_A_SAMA501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		5 / 12 ILE A 534
GLY A 487
ILE A 249
MET A 236
VAL A 253
 None
 1.08A 5n0xA-5w25A:
undetectable		 5n0xA-5w25A:
21.45
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.
5N4I_A_SAMA501_0
(PEPTIDE
N-METHYLTRANSFERASE)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		5 / 12 ILE A 534
GLY A 487
ILE A 249
MET A 236
VAL A 253
 None
 0.99A 5n4iA-5w25A:
undetectable		 5n4iA-5w25A:
22.26
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.
5YOD_H_BEZH201_0
(NS3 PROTEASE)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		4 / 5 HIS A 452
SER A 490
TYR A 477
GLY A 489
 ASP  A 701 (-3.9A)
ASP  A 701 ( 4.6A)
None
ASP  A 701 ( 4.0A)
 0.95A 5yodH-5w25A:
undetectable		 5yodH-5w25A:
15.37
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.
6BNI_B_ADNB602_1
(LYSINE--TRNA LIGASE)		 5w25 ASPARTATE--TRNA(ASP/
ASN) LIGASE
(Mycobacterium
tuberculosis) 		5 / 10 ARG A 219
GLU A 221
PHE A 231
GLY A 537
ILE A 551
 ASP  A 701 (-3.2A)
None
None
None
None
 0.90A 6bniB-5w25A:
28.8		 6bniB-5w25A:
8.31