SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3grp'

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.
1Z95_A_198A501_2
(ANDROGEN RECEPTOR)		 3grp 3-OXOACYL-(ACYL
CARRIERPROTEIN)
REDUCTASE
(Bartonella
henselae) 		4 / 6 ASN A 178
LEU A 159
LEU A 166
ILE A 160
 None
 0.98A 1z95A-3grpA:
undetectable		 1z95A-3grpA:
20.36
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.
2QE6_A_SAMA400_0
(UNCHARACTERIZED
PROTEIN TFU_2867)		 3grp 3-OXOACYL-(ACYL
CARRIERPROTEIN)
REDUCTASE
(Bartonella
henselae) 		5 / 12 ILE A  22
ALA A  21
GLY A  17
ILE A 216
GLY A  13
 None
 0.78A 2qe6A-3grpA:
2.8		 2qe6A-3grpA:
24.84
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.
2QE6_B_SAMB400_0
(UNCHARACTERIZED
PROTEIN TFU_2867)		 3grp 3-OXOACYL-(ACYL
CARRIERPROTEIN)
REDUCTASE
(Bartonella
henselae) 		5 / 12 ILE A  22
ALA A  21
GLY A  17
ILE A 216
GLY A  13
 None
 0.83A 2qe6B-3grpA:
2.7		 2qe6B-3grpA:
24.84
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.
2W9S_C_TOPC1160_1
(DIHYDROFOLATE
REDUCTASE TYPE 1
FROM TN4003)		 3grp 3-OXOACYL-(ACYL
CARRIERPROTEIN)
REDUCTASE
(Bartonella
henselae) 		5 / 10 ILE A  22
ILE A 137
SER A 187
ILE A 185
THR A  12
 None
 1.16A 2w9sC-3grpA:
undetectable		 2w9sC-3grpA:
21.03
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.
3N8Z_A_FLPA701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 3grp 3-OXOACYL-(ACYL
CARRIERPROTEIN)
REDUCTASE
(Bartonella
henselae) 		5 / 12 VAL A  33
LEU A  50
GLY A  13
ALA A  14
LEU A  35
 None
 1.02A 3n8zA-3grpA:
undetectable		 3n8zA-3grpA:
17.24
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.
3PGH_A_FLPA701_1
(CYCLOOXYGENASE-2)		 3grp 3-OXOACYL-(ACYL
CARRIERPROTEIN)
REDUCTASE
(Bartonella
henselae) 		5 / 12 VAL A  33
LEU A  50
GLY A  13
ALA A  14
LEU A  35
 None
 1.10A 3pghA-3grpA:
undetectable		 3pghA-3grpA:
17.72
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.
4E0F_A_RBFA301_2
(RIBOFLAVIN SYNTHASE
SUBUNIT ALPHA)		 3grp 3-OXOACYL-(ACYL
CARRIERPROTEIN)
REDUCTASE
(Bartonella
henselae) 		3 / 3 LYS A 156
THR A 138
ILE A 216
 None
 0.80A 4e0fB-3grpA:
undetectable		 4e0fB-3grpA:
22.59
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.
4IB4_A_ERMA2001_2
(CHIMERA PROTEIN OF
HUMAN
5-HYDROXYTRYPTAMINE
RECEPTOR 2B AND E.
COLI SOLUBLE
CYTOCHROME B562)		 3grp 3-OXOACYL-(ACYL
CARRIERPROTEIN)
REDUCTASE
(Bartonella
henselae) 		4 / 7 LEU A 166
LYS A 164
ASN A 136
LEU A 159
 None
 0.96A 4ib4A-3grpA:
undetectable		 4ib4A-3grpA:
22.22
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.
4PH9_A_IBPA601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3grp 3-OXOACYL-(ACYL
CARRIERPROTEIN)
REDUCTASE
(Bartonella
henselae) 		5 / 10 VAL A  33
LEU A  50
GLY A  13
ALA A  14
LEU A  35
 None
 1.04A 4ph9A-3grpA:
undetectable		 4ph9A-3grpA:
18.84
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.
4PH9_B_IBPB601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3grp 3-OXOACYL-(ACYL
CARRIERPROTEIN)
REDUCTASE
(Bartonella
henselae) 		5 / 10 VAL A  33
LEU A  50
GLY A  13
ALA A  14
LEU A  35
 None
 1.03A 4ph9B-3grpA:
undetectable		 4ph9B-3grpA:
18.84
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.
5VEU_A_RITA602_2
(CYTOCHROME P450 3A5)		 3grp 3-OXOACYL-(ACYL
CARRIERPROTEIN)
REDUCTASE
(Bartonella
henselae) 		3 / 3 ARG A 133
PHE A 218
LEU A 236
 None
 0.83A 5veuA-3grpA:
undetectable		 5veuA-3grpA:
18.43
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.
6AWP_A_FVXA701_1
(SODIUM-DEPENDENT
SEROTONIN
TRANSPORTER)		 3grp 3-OXOACYL-(ACYL
CARRIERPROTEIN)
REDUCTASE
(Bartonella
henselae) 		5 / 9 ASN A 111
ILE A  22
SER A 139
GLY A  17
THR A 220
 None
 1.05A 6awpA-3grpA:
undetectable		 6awpA-3grpA:
18.62
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.
6EXI_A_ADNA503_0
(ADENOSYLHOMOCYSTEINA
SE)		 3grp 3-OXOACYL-(ACYL
CARRIERPROTEIN)
REDUCTASE
(Bartonella
henselae) 		5 / 10 GLY A 211
GLY A 213
GLU A 215
ASN A 239
ILE A 205
 None
 1.22A 6exiA-3grpA:
9.4		 6exiA-3grpA:
16.54
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.
6EXI_B_ADNB503_1
(ADENOSYLHOMOCYSTEINA
SE)		 3grp 3-OXOACYL-(ACYL
CARRIERPROTEIN)
REDUCTASE
(Bartonella
henselae) 		5 / 10 GLY A 211
GLY A 213
GLU A 215
ASN A 239
ILE A 205
 None
 1.18A 6exiB-3grpA:
9.5		 6exiB-3grpA:
16.54
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.
6EXI_D_ADND503_0
(ADENOSYLHOMOCYSTEINA
SE)		 3grp 3-OXOACYL-(ACYL
CARRIERPROTEIN)
REDUCTASE
(Bartonella
henselae) 		5 / 12 GLY A 211
GLY A 213
GLU A 215
ASN A 239
ILE A 205
 None
 1.20A 6exiC-3grpA:
8.7
6exiD-3grpA:
8.7		 6exiC-3grpA:
16.54
6exiD-3grpA:
16.54