SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3wgh'

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.
1JTX_A_CVIA200_0
(HYPOTHETICAL
TRANSCRIPTIONAL
REGULATOR IN QACA
5'REGION)		 3wgh REDOX-SENSING
TRANSCRIPTIONAL
REPRESSOR REX
(Thermoanaerobact
er
ethanolicus) 		5 / 12 THR A 137
ILE A 147
ILE A 171
ILE A 127
ALA A  92
 None
 1.14A 1jtxA-3wghA:
3.2		 1jtxA-3wghA:
21.69
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.
1T7I_A_017A200_2
(POL POLYPROTEIN)		 3wgh REDOX-SENSING
TRANSCRIPTIONAL
REPRESSOR REX
(Thermoanaerobact
er
ethanolicus) 		4 / 7 ALA A 163
VAL A 184
GLY A 150
ILE A 151
 None
 0.84A 1t7iB-3wghA:
undetectable		 1t7iB-3wghA:
21.70
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.
1T7J_A_478A200_2
(POL POLYPROTEIN)		 3wgh REDOX-SENSING
TRANSCRIPTIONAL
REPRESSOR REX
(Thermoanaerobact
er
ethanolicus) 		4 / 7 ALA A 163
VAL A 184
GLY A 150
ILE A 151
 None
 0.84A 1t7jB-3wghA:
undetectable		 1t7jB-3wghA:
21.70
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.
1TW4_A_CHDA130_1
(FATTY ACID-BINDING
PROTEIN)		 3wgh REDOX-SENSING
TRANSCRIPTIONAL
REPRESSOR REX
(Thermoanaerobact
er
ethanolicus) 		3 / 3 TYR A  66
ARG A  14
GLN A  48
 None
 0.97A 1tw4A-3wghA:
undetectable		 1tw4A-3wghA:
17.43
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.
2F8G_B_017B401_1
(POL POLYPROTEIN)		 3wgh REDOX-SENSING
TRANSCRIPTIONAL
REPRESSOR REX
(Thermoanaerobact
er
ethanolicus) 		5 / 12 GLY A  96
ASP A 117
VAL A 132
VAL A 130
ILE A 115
 None
NAI  A 301 (-2.8A)
None
None
None
 1.06A 2f8gA-3wghA:
undetectable		 2f8gA-3wghA:
19.34
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.
3NU9_A_478A401_1
(PROTEASE)		 3wgh REDOX-SENSING
TRANSCRIPTIONAL
REPRESSOR REX
(Thermoanaerobact
er
ethanolicus) 		4 / 8 ALA A 163
VAL A 184
GLY A 150
ILE A 151
 None
 0.77A 3nu9A-3wghA:
undetectable		 3nu9A-3wghA:
19.81
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.
3OGP_A_017A200_2
(FIV PROTEASE)		 3wgh REDOX-SENSING
TRANSCRIPTIONAL
REPRESSOR REX
(Thermoanaerobact
er
ethanolicus) 		5 / 10 ALA A 163
VAL A 184
GLY A 150
ILE A 151
LEU A 182
 None
 1.01A 3ogpB-3wghA:
undetectable		 3ogpB-3wghA:
17.86
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.
4RTS_A_SAMA301_0
(DNA ADENINE
METHYLASE)		 3wgh REDOX-SENSING
TRANSCRIPTIONAL
REPRESSOR REX
(Thermoanaerobact
er
ethanolicus) 		5 / 12 GLY A  93
ASP A 117
ILE A 118
ASN A 119
PRO A 155
 NAI  A 301 (-3.3A)
NAI  A 301 (-2.8A)
NAI  A 301 (-4.1A)
None
NAI  A 301 (-4.3A)
 0.85A 4rtsA-3wghA:
undetectable		 4rtsA-3wghA:
19.49
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.
5TDM_A_ADNA904_1
(ATP-CITRATE SYNTHASE)		 3wgh REDOX-SENSING
TRANSCRIPTIONAL
REPRESSOR REX
(Thermoanaerobact
er
ethanolicus) 		4 / 4 THR A 162
ASP A 164
ARG A 168
LEU A 166
 NAI  A 301 (-3.7A)
None
None
None
 1.00A 5tdmA-3wghA:
4.3		 5tdmA-3wghA:
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.
5TDZ_A_ADNA905_1
(ATP-CITRATE SYNTHASE)		 3wgh REDOX-SENSING
TRANSCRIPTIONAL
REPRESSOR REX
(Thermoanaerobact
er
ethanolicus) 		4 / 6 THR A 162
ASP A 164
ARG A 168
LEU A 166
 NAI  A 301 (-3.7A)
None
None
None
 1.00A 5tdzA-3wghA:
4.5		 5tdzA-3wghA:
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.
6DIL_B_TPVB201_0
(HIV-1 PROTEASE)		 3wgh REDOX-SENSING
TRANSCRIPTIONAL
REPRESSOR REX
(Thermoanaerobact
er
ethanolicus) 		5 / 12 ASP A 117
VAL A 132
GLY A  96
ILE A  99
VAL A 130
 NAI  A 301 (-2.8A)
None
None
None
None
 0.79A 6dilA-3wghA:
undetectable		 6dilA-3wghA:
16.44
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.
6EMU_A_SAMA501_0
(TRNA
(GUANINE(9)-/ADENINE
(9)-N1)-METHYLTRANSF
ERASE)		 3wgh REDOX-SENSING
TRANSCRIPTIONAL
REPRESSOR REX
(Thermoanaerobact
er
ethanolicus) 		6 / 12 ILE A  89
GLY A  91
ILE A 154
THR A 162
ILE A 149
ILE A 151
 None
NAI  A 301 ( 3.7A)
NAI  A 301 (-3.7A)
NAI  A 301 (-3.7A)
None
None
 1.41A 6emuA-3wghA:
3.8		 6emuA-3wghA:
23.97
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.
6GSD_A_STRA401_0
(PROGESTERONE
5-BETA-REDUCTASE)		 3wgh REDOX-SENSING
TRANSCRIPTIONAL
REPRESSOR REX
(Thermoanaerobact
er
ethanolicus) 		5 / 12 ARG A 168
VAL A 167
ILE A 171
VAL A 138
ILE A 142
 None
 1.48A 6gsdA-3wghA:
6.8		 6gsdA-3wghA:
16.96