SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2qc3'

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.
1D0V_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 2qc3 MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE
(Mycobacterium
tuberculosis) 		4 / 8 GLY A  93
GLY A 272
LEU A 274
SER A  11
 None
 0.67A 1d0vA-2qc3A:
2.3		 1d0vA-2qc3A:
26.58
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.
1HBP_A_RTLA184_0
(RETINOL BINDING
PROTEIN)		 2qc3 MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE
(Mycobacterium
tuberculosis) 		5 / 11 LEU A 112
ALA A 190
ALA A 121
MET A 120
LEU A 244
 None
None
None
ACY  A 500 ( 4.4A)
None
 1.33A 1hbpA-2qc3A:
undetectable		 1hbpA-2qc3A:
21.74
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.
1IIU_A_RTLA176_0
(PLASMA
RETINOL-BINDING
PROTEIN)		 2qc3 MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE
(Mycobacterium
tuberculosis) 		5 / 11 LEU A 112
ALA A 190
ALA A 121
MET A 120
LEU A 244
 None
None
None
ACY  A 500 ( 4.4A)
None
 1.32A 1iiuA-2qc3A:
undetectable		 1iiuA-2qc3A:
21.68
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.
1JHA_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 2qc3 MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE
(Mycobacterium
tuberculosis) 		4 / 8 GLY A  93
GLY A 272
LEU A 274
SER A  11
 None
 0.66A 1jhaA-2qc3A:
undetectable		 1jhaA-2qc3A:
27.30
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.
1JHQ_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 2qc3 MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE
(Mycobacterium
tuberculosis) 		4 / 8 GLY A  93
GLY A 272
LEU A 274
SER A  11
 None
 0.67A 1jhqA-2qc3A:
undetectable		 1jhqA-2qc3A:
27.30
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.
1JHV_A_NIOA991_1
(NICOTINATE
MONONUCLEOTIDE:5,6-D
IMETHYLBENZIMIDAZOLE
PHOSPHORIBOSYLTRANSF
ERASE)		 2qc3 MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE
(Mycobacterium
tuberculosis) 		4 / 8 GLY A  93
GLY A 272
LEU A 274
SER A  11
 None
 0.65A 1jhvA-2qc3A:
undetectable		 1jhvA-2qc3A:
27.30
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.
2QD2_A_CHDA426_0
(FERROCHELATASE)		 2qc3 MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE
(Mycobacterium
tuberculosis) 		4 / 4 LEU A  62
PRO A  61
LEU A  41
ARG A  43
 None
 1.16A 2qd2A-2qc3A:
undetectable		 2qd2A-2qc3A:
21.85
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.
2QL8_A_BEZA143_0
(PUTATIVE REDOX
PROTEIN)		 2qc3 MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE
(Mycobacterium
tuberculosis) 		4 / 7 ALA A  66
THR A  67
ALA A  70
PRO A   7
 None
 0.60A 2ql8A-2qc3A:
undetectable
2ql8B-2qc3A:
undetectable		 2ql8A-2qc3A:
18.58
2ql8B-2qc3A:
18.58
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.
4FN9_A_STRA301_1
(STEROID RECEPTOR 2)		 2qc3 MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE
(Mycobacterium
tuberculosis) 		5 / 12 LEU A 168
LEU A 171
LEU A 174
ALA A 175
ALA A 133
 None
 0.88A 4fn9A-2qc3A:
undetectable		 4fn9A-2qc3A:
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.
4LTW_A_STRA301_1
(ANCESTRAL STEROID
RECEPTOR 2)		 2qc3 MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE
(Mycobacterium
tuberculosis) 		5 / 12 LEU A 168
LEU A 171
LEU A 174
ALA A 175
LEU A 187
 None
 1.12A 4ltwA-2qc3A:
undetectable		 4ltwA-2qc3A:
22.86
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.
4V20_A_ACTA1444_0
(CELLOBIOHYDROLASE)		 2qc3 MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE
(Mycobacterium
tuberculosis) 		4 / 5 GLY A 272
THR A 273
GLY A   8
GLU A 267
 None
None
ACY  A 500 ( 4.7A)
None
 0.72A 4v20A-2qc3A:
undetectable		 4v20A-2qc3A:
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.
5AD9_A_H4BA760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 2qc3 MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE
(Mycobacterium
tuberculosis) 		4 / 7 VAL A 290
PHE A 268
HIS A  71
GLU A  73
 None
 1.32A 5ad9A-2qc3A:
undetectable
5ad9B-2qc3A:
undetectable		 5ad9A-2qc3A:
23.08
5ad9B-2qc3A:
23.08
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.
5KM8_B_L8PB201_1
(HISTIDINE TRIAD
NUCLEOTIDE-BINDING
PROTEIN 2,
MITOCHONDRIAL)		 2qc3 MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE
(Mycobacterium
tuberculosis) 		4 / 8 GLN A   9
ASN A 155
ALA A 154
HIS A  90
 ACY  A 500 (-3.8A)
None
None
None
 1.15A 5km8A-2qc3A:
undetectable
5km8B-2qc3A:
undetectable		 5km8A-2qc3A:
21.18
5km8B-2qc3A:
21.18
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.
5NM5_B_LOCB502_2
(TUBULIN BETA-2B
CHAIN)		 2qc3 MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE
(Mycobacterium
tuberculosis) 		5 / 12 LEU A 222
THR A 263
ALA A   3
ALA A  88
ILE A 265
 None
 1.25A 5nm5B-2qc3A:
undetectable		 5nm5B-2qc3A:
21.14
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.
5OJ0_A_9WTA801_0
(PENICILLIN-BINDING
PROTEIN 2X)		 2qc3 MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE
(Mycobacterium
tuberculosis) 		5 / 12 ARG A 249
ASN A 155
THR A 273
GLY A   8
GLN A 243
 None
None
None
ACY  A 500 ( 4.7A)
None
 1.36A 5oj0A-2qc3A:
undetectable		 5oj0A-2qc3A:
20.14
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.
5X7F_A_SAMA301_0
(PUTATIVE
O-METHYLTRANSFERASE
RV1220C)		 2qc3 MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE
(Mycobacterium
tuberculosis) 		5 / 12 VAL A  64
GLY A  89
VAL A  92
ILE A  86
ALA A 219
 None
None
ACY  A 500 (-3.4A)
None
None
 0.95A 5x7fA-2qc3A:
undetectable		 5x7fA-2qc3A:
26.73
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.
6BRD_C_RFPC502_1
(RIFAMPIN
MONOOXYGENASE)		 2qc3 MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE
(Mycobacterium
tuberculosis) 		5 / 12 VAL A 184
VAL A 134
PRO A 128
THR A 129
GLY A 130
 None
 1.11A 6brdC-2qc3A:
undetectable		 6brdC-2qc3A:
13.91
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.
6FBV_D_FI8D1904_0
(DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA
DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA')		 2qc3 MALONYL COA-ACYL
CARRIER PROTEIN
TRANSACYLASE
(Mycobacterium
tuberculosis) 		4 / 8 ILE A  95
GLN A  60
VAL A 189
SER A  11
 None
ACY  A 500 ( 4.7A)
None
None
 1.13A 6fbvC-2qc3A:
0.1		 6fbvC-2qc3A:
14.09