SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3hpx'

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)		 3hpx 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-3hpxA:
undetectable		 1a27A-3hpxA:
20.71
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.
1NX9_A_AICA5001_1
(ALPHA-AMINO ACID
ESTER HYDROLASE)		 3hpx 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 8 TYR A 107
GLU A 309
HIS A 287
TYR A 263
 None
None
NI  A 701 (-3.3A)
None
 1.32A 1nx9A-3hpxA:
undetectable		 1nx9A-3hpxA:
21.49
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.
1NX9_B_AICB5002_1
(ALPHA-AMINO ACID
ESTER HYDROLASE)		 3hpx 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 8 TYR A 107
GLU A 309
HIS A 287
TYR A 263
 None
None
NI  A 701 (-3.3A)
None
 1.32A 1nx9B-3hpxA:
undetectable		 1nx9B-3hpxA:
21.49
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.
1NX9_D_AICD5004_1
(ALPHA-AMINO ACID
ESTER HYDROLASE)		 3hpx 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 8 TYR A 107
GLU A 309
HIS A 287
TYR A 263
 None
None
NI  A 701 (-3.3A)
None
 1.33A 1nx9D-3hpxA:
undetectable		 1nx9D-3hpxA:
21.49
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.
2C8A_D_NCAD1247_0
(MONO-ADP-RIBOSYLTRAN
SFERASE C3)		 3hpx 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 7 GLY A 113
SER A 116
PHE A 114
ARG A  80
 None
 1.08A 2c8aD-3hpxA:
undetectable		 2c8aD-3hpxA:
18.35
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.
2GJ5_A_VD3A164_1
(BETA-LACTOGLOBULIN)		 3hpx 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 5 ASP A 306
LEU A 282
MET A 270
ARG A 277
 None
 1.35A 2gj5A-3hpxA:
undetectable		 2gj5A-3hpxA:
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.
2NNI_A_MTKA501_2
(CYTOCHROME P450 2C8)		 3hpx 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 8 ILE A 308
ILE A 267
ASN A 321
VAL A 322
ALA A 296
 None
None
NI  A 701 (-2.7A)
None
None
 1.20A 2nniA-3hpxA:
undetectable		 2nniA-3hpxA:
19.77
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.
2XRZ_A_ACTA1470_0
(DEOXYRIBODIPYRIMIDIN
E PHOTOLYASE)		 3hpx 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 5 ARG A 272
ASP A 265
GLU A 268
TRP A  63
 None
 1.36A 2xrzA-3hpxA:
undetectable		 2xrzA-3hpxA:
21.72
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)		 3hpx 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 ILE A 383
GLY A 377
SER A 378
ALA A 382
VAL A 425
 None
 1.17A 2yvlC-3hpxA:
undetectable		 2yvlC-3hpxA:
20.64
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)		 3hpx 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		3 / 3 VAL A  53
VAL A 262
SER A 266
 None
 0.47A 3n8xB-3hpxA:
undetectable		 3n8xB-3hpxA:
19.43
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.
3VLN_A_ASCA904_0
(GLUTATHIONE
S-TRANSFERASE
OMEGA-1)		 3hpx 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 6 PHE A 114
ARG A  80
LEU A 150
PRO A 115
 None
 1.33A 3vlnA-3hpxA:
undetectable		 3vlnA-3hpxA:
22.45
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.
3ZTV_A_ADNA1600_1
(NAD NUCLEOTIDASE)		 3hpx 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 9 ASN A 321
GLY A 316
GLY A 320
GLY A  82
ASP A  81
 NI  A 701 (-2.7A)
None
None
None
NI  A 701 (-2.5A)
 1.15A 3ztvA-3hpxA:
undetectable		 3ztvA-3hpxA:
19.19
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)		 3hpx 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 8 VAL A 142
CYH A  75
ILE A 140
ILE A 165
 None
 0.99A 4afgD-3hpxA:
undetectable
4afgE-3hpxA:
undetectable		 4afgD-3hpxA:
17.99
4afgE-3hpxA:
17.99
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.
4AFG_C_QMRC1214_1
(CAPITELLA TELETA
ACHBP)		 3hpx 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 8 VAL A 142
CYH A  75
ILE A 140
ILE A 165
 None
 1.03A 4afgD-3hpxA:
undetectable
4afgE-3hpxA:
undetectable		 4afgD-3hpxA:
17.99
4afgE-3hpxA:
17.99
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.
4H2F_A_ADNA601_1
(5'-NUCLEOTIDASE)		 3hpx 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 9 ASN A 321
GLY A 316
GLY A 320
GLY A  82
ASP A  81
 NI  A 701 (-2.7A)
None
None
None
NI  A 701 (-2.5A)
 1.16A 4h2fA-3hpxA:
2.5		 4h2fA-3hpxA:
22.74
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.
4H2G_A_ADNA603_1
(5'-NUCLEOTIDASE)		 3hpx 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 9 ASN A 321
GLY A 316
GLY A 320
GLY A  82
ASP A  81
 NI  A 701 (-2.7A)
None
None
None
NI  A 701 (-2.5A)
 1.10A 4h2gA-3hpxA:
2.3		 4h2gA-3hpxA:
22.74
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)		 3hpx 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		4 / 5 LEU A 251
ASP A 306
GLU A 309
VAL A 322
 None
 1.26A 4nkvA-3hpxA:
undetectable		 4nkvA-3hpxA:
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.
4ZJO_A_ERYA1101_0
(MULTIDRUG EFFLUX
PUMP SUBUNIT ACRB)		 3hpx 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 ASN A 250
SER A 173
ALA A 253
GLU A 111
GLU A 309
 None
 1.38A 4zjoA-3hpxA:
undetectable		 4zjoA-3hpxA:
17.50
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)		 3hpx 2-ISOPROPYLMALATE
SYNTHASE
(Mycobacterium
tuberculosis) 		5 / 12 GLY A 195
ALA A 192
PHE A 249
TYR A 215
VAL A 231
 None
 1.24A 5hw4A-3hpxA:
undetectable		 5hw4A-3hpxA:
22.57