SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3k2i'

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.
1EA1_A_TPFA470_1
(CYTOCHROME P450
51-LIKE RV0764C)		 3k2i ACYL-COENZYME A
THIOESTERASE 4
(Homo
sapiens) 		4 / 8 TYR A 190
PHE A 208
THR A 263
LEU A 233
 None
None
None
CL  A 423 ( 4.1A)
 1.22A 1ea1A-3k2iA:
undetectable		 1ea1A-3k2iA:
22.29
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.
1SH9_B_RITB301_2
(POL POLYPROTEIN)		 3k2i ACYL-COENZYME A
THIOESTERASE 4
(Homo
sapiens) 		5 / 10 GLY A 168
ILE A 231
GLY A 234
ILE A 237
ALA A 187
 None
 1.07A 1sh9B-3k2iA:
undetectable		 1sh9B-3k2iA:
16.22
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.
2A1O_B_CAMB2422_0
(CYTOCHROME P450-CAM)		 3k2i ACYL-COENZYME A
THIOESTERASE 4
(Homo
sapiens) 		5 / 9 PHE A 208
TYR A 207
LEU A 196
GLY A 169
ILE A 163
 None
 1.27A 2a1oB-3k2iA:
undetectable		 2a1oB-3k2iA:
22.11
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.
3BJW_F_SVRF509_2
(PHOSPHOLIPASE A2)		 3k2i ACYL-COENZYME A
THIOESTERASE 4
(Homo
sapiens) 		4 / 8 ASN A 305
LYS A 304
PRO A 310
PHE A 244
 None
 1.38A 3bjwD-3k2iA:
undetectable		 3bjwD-3k2iA:
12.71
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.
3MBG_A_ACTA207_0
(FAD-LINKED
SULFHYDRYL OXIDASE
ALR)		 3k2i ACYL-COENZYME A
THIOESTERASE 4
(Homo
sapiens) 		4 / 7 LEU A 178
ASP A 162
ARG A 174
ALA A 175
 None
 1.19A 3mbgA-3k2iA:
undetectable
3mbgB-3k2iA:
undetectable		 3mbgA-3k2iA:
15.82
3mbgB-3k2iA:
15.82
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_A_NIMA701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 3k2i ACYL-COENZYME A
THIOESTERASE 4
(Homo
sapiens) 		5 / 12 LEU A 229
ILE A 231
GLY A 234
ALA A 235
LEU A 239
 None
 1.14A 3n8xA-3k2iA:
undetectable		 3n8xA-3k2iA:
21.94
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.
3NDI_A_SAMA601_0
(METHYLTRANSFERASE)		 3k2i ACYL-COENZYME A
THIOESTERASE 4
(Homo
sapiens) 		5 / 12 ILE A 160
PHE A 183
PHE A 406
ALA A 187
ILE A 226
 None
 1.22A 3ndiA-3k2iA:
2.4		 3ndiA-3k2iA:
24.63
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.
4L4C_B_CAMB502_0
(CAMPHOR
5-MONOOXYGENASE)		 3k2i ACYL-COENZYME A
THIOESTERASE 4
(Homo
sapiens) 		4 / 8 PHE A 208
TYR A 207
LEU A 196
ILE A 237
 None
 0.97A 4l4cB-3k2iA:
undetectable		 4l4cB-3k2iA:
23.00
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.
4LRH_A_FOLA301_1
(FOLATE RECEPTOR
ALPHA)		 3k2i ACYL-COENZYME A
THIOESTERASE 4
(Homo
sapiens) 		3 / 3 ASP A 236
TRP A 384
SER A 253
 None
 1.04A 4lrhA-3k2iA:
undetectable		 4lrhA-3k2iA:
16.32
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.
4QWP_B_GCSB305_1
(CHITOSANASE)		 3k2i ACYL-COENZYME A
THIOESTERASE 4
(Homo
sapiens) 		3 / 3 GLY A 153
PRO A 154
GLN A 220
 None
 0.51A 4qwpB-3k2iA:
undetectable		 4qwpB-3k2iA:
19.91