SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3ti2'

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.
1MX1_D_THAD4_2
(LIVER
CARBOXYLESTERASE I)		 3ti2 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE
(Vibrio
cholerae) 		3 / 3 PHE A  82
LEU A  34
MET A 179
 None
 0.78A 1mx1D-3ti2A:
undetectable		 1mx1D-3ti2A:
20.22
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.
1QAB_E_RTLE1_0
(PROTEIN (RETINOL
BINDING PROTEIN))		 3ti2 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE
(Vibrio
cholerae) 		5 / 11 PHE A 173
LEU A 129
ALA A 103
MET A 121
GLN A 172
 None
None
None
None
CL  A   1 ( 4.6A)
 1.27A 1qabE-3ti2A:
undetectable		 1qabE-3ti2A:
20.61
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.
1SBR_A_VIBA501_1
(YKOF)		 3ti2 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE
(Vibrio
cholerae) 		4 / 8 SER A  21
LEU A  45
ILE A  50
THR A  97
 None
None
None
CL  A 245 ( 4.4A)
 0.98A 1sbrA-3ti2A:
undetectable		 1sbrA-3ti2A:
21.86
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.
1ZUC_B_T98B202_1
(PROGESTERONE
RECEPTOR)		 3ti2 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE
(Vibrio
cholerae) 		5 / 12 LEU A  54
LEU A  57
LEU A  60
LEU A  34
LEU A  41
 None
 1.25A 1zucB-3ti2A:
undetectable		 1zucB-3ti2A:
22.99
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.
2VDY_A_HCYA1384_1
(CORTICOSTEROID-BINDI
NG GLOBULIN)		 3ti2 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE
(Vibrio
cholerae) 		5 / 12 SER A  23
VAL A  24
THR A  39
ARG A  27
PHE A 238
 None
None
None
CL  A   1 ( 3.0A)
None
 1.37A 2vdyA-3ti2A:
undetectable		 2vdyA-3ti2A:
23.66
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.
4C49_B_HCYB1384_1
(CORTICOSTEROID-BINDI
NG GLOBULIN)		 3ti2 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE
(Vibrio
cholerae) 		5 / 12 SER A  23
VAL A  24
THR A  39
ARG A  27
PHE A 238
 None
None
None
CL  A   1 ( 3.0A)
None
 1.45A 4c49B-3ti2A:
undetectable		 4c49B-3ti2A:
23.95
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.
4C49_C_HCYC1384_1
(CORTICOSTEROID-BINDI
NG GLOBULIN)		 3ti2 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE
(Vibrio
cholerae) 		5 / 12 SER A  23
VAL A  24
THR A  39
ARG A  27
PHE A 238
 None
None
None
CL  A   1 ( 3.0A)
None
 1.37A 4c49C-3ti2A:
undetectable		 4c49C-3ti2A:
23.95
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.
4OT2_A_NPSA602_1
(SERUM ALBUMIN)		 3ti2 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE
(Vibrio
cholerae) 		4 / 6 ARG A  51
ASP A  48
LEU A  44
SER A  67
 None
 0.80A 4ot2A-3ti2A:
undetectable		 4ot2A-3ti2A:
16.78
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.
4QDC_A_ASDA404_1
(3-KETOSTEROID
9ALPHA-HYDROXYLASE
OXYGENASE)		 3ti2 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE
(Vibrio
cholerae) 		5 / 12 MET A 179
LEU A  34
SER A 180
LEU A 106
PHE A  82
 None
 0.95A 4qdcA-3ti2A:
undetectable		 4qdcA-3ti2A:
22.16
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.
5ZSF_A_6T0A910_0
(TOLL-LIKE RECEPTOR 7)		 3ti2 3-PHOSPHOSHIKIMATE
1-CARBOXYVINYLTRANSF
ERASE
(Vibrio
cholerae) 		4 / 7 LEU A 206
ILE A 204
THR A 205
TYR A 221
 None
 0.91A 5zsfA-3ti2A:
undetectable
5zsfB-3ti2A:
undetectable		 5zsfA-3ti2A:
15.45
5zsfB-3ti2A:
15.45