SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3hps'

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.
1A27_A_ESTA350_1
(17-BETA-HYDROXYSTERO
ID-DEHYDROGENASE)		 3hps 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 VAL A 408
GLY A 386
MET A 390
LEU A 387
ASN A 384
 None
 1.40A 1a27A-3hpsA:
2.2		 1a27A-3hpsA:
18.76
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.
2GJ5_A_VD3A164_1
(BETA-LACTOGLOBULIN)		 3hps 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 5 ASP A 306
LEU A 282
MET A 270
ARG A 277
 None
 1.35A 2gj5A-3hpsA:
undetectable		 2gj5A-3hpsA:
12.68
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.
2IGT_A_SAMA1001_1
(SAM DEPENDENT
METHYLTRANSFERASE)		 3hps 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		3 / 3 ASP A 395
ASP A 400
ASP A 388
 None
 0.74A 2igtA-3hpsA:
3.0		 2igtA-3hpsA:
22.00
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.
2IGT_B_SAMB1002_1
(SAM DEPENDENT
METHYLTRANSFERASE)		 3hps 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		3 / 3 ASP A 395
ASP A 400
ASP A 388
 None
 0.79A 2igtB-3hpsA:
3.1		 2igtB-3hpsA:
22.00
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.
2VCT_D_ASDD1223_1
(GLUTATHIONE
S-TRANSFERASE A2)		 3hps 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 7 ILE A 134
LEU A 102
PHE A  99
PHE A 124
 None
 0.81A 2vctD-3hpsA:
undetectable		 2vctD-3hpsA:
15.68
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.
2XRZ_A_ACTA1470_0
(DEOXYRIBODIPYRIMIDIN
E PHOTOLYASE)		 3hps 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 5 ARG A 272
ASP A 265
GLU A 268
TRP A  63
 None
 1.31A 2xrzA-3hpsA:
undetectable		 2xrzA-3hpsA:
21.46
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.
2YVL_C_SAMC604_0
(HYPOTHETICAL PROTEIN)		 3hps 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 ILE A 383
GLY A 377
SER A 378
ALA A 382
VAL A 425
 None
 1.18A 2yvlC-3hpsA:
2.3		 2yvlC-3hpsA:
17.45
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.
3BOY_A_HISA1001_0
(HUT OPERON POSITIVE
REGULATORY PROTEIN)		 3hps 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 10 ILE A 623
GLY A 622
ALA A 634
TYR A 570
HIS A 557
 None
 1.06A 3boyA-3hpsA:
undetectable
3boyC-3hpsA:
undetectable		 3boyA-3hpsA:
12.90
3boyC-3hpsA:
12.90
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.
3BOY_A_HISA3001_0
(HUT OPERON POSITIVE
REGULATORY PROTEIN)		 3hps 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 10 TYR A 570
HIS A 557
ILE A 623
GLY A 622
ALA A 634
 None
 1.06A 3boyB-3hpsA:
undetectable
3boyC-3hpsA:
undetectable		 3boyB-3hpsA:
12.90
3boyC-3hpsA:
12.90
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.
3N8X_B_NIMB1701_2
(PROSTAGLANDIN G/H
SYNTHASE 1)		 3hps 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		3 / 3 VAL A  53
VAL A 262
SER A 266
 None
 0.45A 3n8xB-3hpsA:
undetectable		 3n8xB-3hpsA:
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.
4AFG_C_QMRC1214_1
(CAPITELLA TELETA
ACHBP)		 3hps 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 8 VAL A 142
CYH A  75
ILE A 140
ILE A 165
 None
 0.99A 4afgD-3hpsA:
undetectable
4afgE-3hpsA:
undetectable		 4afgD-3hpsA:
16.04
4afgE-3hpsA:
16.04
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.
4AFG_C_QMRC1214_1
(CAPITELLA TELETA
ACHBP)		 3hps 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 8 VAL A 142
CYH A  75
ILE A 140
ILE A 165
 None
 1.00A 4afgD-3hpsA:
undetectable
4afgE-3hpsA:
undetectable		 4afgD-3hpsA:
16.04
4afgE-3hpsA:
16.04
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.
4ASD_A_BAXA1500_2
(VASCULAR ENDOTHELIAL
GROWTH FACTOR
RECEPTOR 2)		 3hps 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 6 ILE A 239
VAL A 280
LEU A 282
ILE A 248
 None
 0.87A 4asdA-3hpsA:
undetectable		 4asdA-3hpsA:
18.67
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.
4NKV_A_AERA601_2
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 3hps 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 5 LEU A 251
ASP A 306
GLU A 309
VAL A 322
 None
 1.29A 4nkvA-3hpsA:
undetectable		 4nkvA-3hpsA:
20.73
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.
4ZJO_A_ERYA1101_0
(MULTIDRUG EFFLUX
PUMP SUBUNIT ACRB)		 3hps 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 ASN A 250
SER A 173
ALA A 253
GLU A 111
GLU A 309
 COI  A 702 (-4.5A)
None
None
None
None
 1.34A 4zjoA-3hpsA:
undetectable		 4zjoA-3hpsA:
20.62
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.
5HW4_A_SAMA801_0
(RIBOSOMAL RNA SMALL
SUBUNIT
METHYLTRANSFERASE I)		 3hps 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 GLY A 195
ALA A 192
PHE A 249
TYR A 215
VAL A 231
 None
 1.25A 5hw4A-3hpsA:
undetectable		 5hw4A-3hpsA:
18.21
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.
5Z6K_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 3hps 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		3 / 3 MET A  90
ASP A  78
ARG A 104
 None
 1.21A 5z6kA-3hpsA:
undetectable		 5z6kA-3hpsA:
13.49