SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1e5i'

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
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UOB_A_PNNA1311_0
(DEACETOXYCEPHALOSPOR
IN C SYNTHETASE)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		5 / 12 LEU A 158
HIS A 243
ASP A 185
LEU A 223
PHE A 264
 None
FE2  A 901 ( 3.4A)
FE2  A 901 ( 2.2A)
None
AKG  A 902 (-4.9A)
 1.43A 1uobA-1e5iA:
44.6		 1uobA-1e5iA:
99.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UOB_A_PNNA1311_0
(DEACETOXYCEPHALOSPOR
IN C SYNTHETASE)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		12 / 12 MET A  73
SER A 102
LEU A 158
MET A 180
HIS A 183
ASP A 185
LEU A 204
HIS A 243
SER A 260
VAL A 262
PHE A 264
ILE A 305
 None
None
None
AKG  A 902 ( 3.7A)
FE2  A 901 ( 3.5A)
FE2  A 901 ( 2.2A)
AKG  A 902 ( 3.7A)
FE2  A 901 ( 3.4A)
AKG  A 902 (-2.8A)
AKG  A 902 ( 4.8A)
AKG  A 902 (-4.9A)
AKG  A 902 (-4.5A)
 0.22A 1uobA-1e5iA:
44.6		 1uobA-1e5iA:
99.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UOB_A_PNNA1311_0
(DEACETOXYCEPHALOSPOR
IN C SYNTHETASE)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		7 / 12 SER A 102
LEU A 158
HIS A 243
ASP A 185
SER A 260
VAL A 262
PHE A 264
 None
None
FE2  A 901 ( 3.4A)
FE2  A 901 ( 2.2A)
AKG  A 902 (-2.8A)
AKG  A 902 ( 4.8A)
AKG  A 902 (-4.9A)
 1.36A 1uobA-1e5iA:
44.6		 1uobA-1e5iA:
99.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UOF_A_PNNA1312_0
(DEACETOXYCEPHALOSPOR
IN C SYNTHETASE)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		7 / 11 ARG A 179
HIS A 183
ASP A 185
THR A 190
HIS A 243
VAL A 245
VAL A 262
 None
FE2  A 901 ( 3.5A)
FE2  A 901 ( 2.2A)
None
FE2  A 901 ( 3.4A)
None
AKG  A 902 ( 4.8A)
 1.04A 1uofA-1e5iA:
42.9		 1uofA-1e5iA:
99.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UOF_A_PNNA1312_0
(DEACETOXYCEPHALOSPOR
IN C SYNTHETASE)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		7 / 11 ARG A 179
MET A 180
HIS A 183
ASP A 185
THR A 190
HIS A 243
VAL A 245
 None
AKG  A 902 ( 3.7A)
FE2  A 901 ( 3.5A)
FE2  A 901 ( 2.2A)
None
FE2  A 901 ( 3.4A)
None
 1.11A 1uofA-1e5iA:
42.9		 1uofA-1e5iA:
99.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UOF_A_PNNA1312_0
(DEACETOXYCEPHALOSPOR
IN C SYNTHETASE)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		6 / 11 HIS A 183
ASP A 185
THR A 190
ARG A 258
SER A 260
VAL A 262
 FE2  A 901 ( 3.5A)
FE2  A 901 ( 2.2A)
None
AKG  A 902 (-2.8A)
AKG  A 902 (-2.8A)
AKG  A 902 ( 4.8A)
 0.79A 1uofA-1e5iA:
42.9		 1uofA-1e5iA:
99.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1UOF_A_PNNA1312_0
(DEACETOXYCEPHALOSPOR
IN C SYNTHETASE)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		7 / 11 HIS A 183
ASP A 185
THR A 190
HIS A 243
VAL A 245
SER A 260
VAL A 262
 FE2  A 901 ( 3.5A)
FE2  A 901 ( 2.2A)
None
FE2  A 901 ( 3.4A)
None
AKG  A 902 (-2.8A)
AKG  A 902 ( 4.8A)
 0.50A 1uofA-1e5iA:
42.9		 1uofA-1e5iA:
99.67
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.
2CC8_A_RBFA1067_1
(VNG1446H)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		3 / 3 PHE A 161
VAL A  51
TRP A 119
 None
 0.90A 2cc8A-1e5iA:
0.0		 2cc8A-1e5iA:
14.77
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.
2CCB_A_RBFA1067_1
(VNG1446H)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		3 / 3 PHE A 161
VAL A  51
TRP A 119
 None
 0.90A 2ccbA-1e5iA:
0.0		 2ccbA-1e5iA:
14.77
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.
2QQT_A_AINA596_1
(LACTOPEROXIDASE)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		4 / 6 ARG A  24
GLU A  21
PHE A   8
PRO A   6
 None
 1.00A 2qqtA-1e5iA:
0.0		 2qqtA-1e5iA:
20.47
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.
2VX9_A_RBFA1064_1
(DODECIN)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		3 / 3 PHE A 161
VAL A  51
TRP A 119
 None
 0.90A 2vx9A-1e5iA:
0.0		 2vx9A-1e5iA:
13.40
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.
3GCL_A_AINA609_1
(LACTOPEROXIDASE)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		4 / 6 ARG A  24
GLU A  21
PHE A   8
PRO A   6
 None
 0.90A 3gclA-1e5iA:
0.0		 3gclA-1e5iA:
20.47
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.
3MDT_A_VORA506_1
(CHOLESTEROL
24-HYDROXYLASE)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		5 / 9 LEU A 153
SER A 130
ILE A 229
ALA A 230
THR A 234
 None
 1.13A 3mdtA-1e5iA:
undetectable		 3mdtA-1e5iA:
20.17
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.
3N23_C_OBNC1_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		5 / 11 PRO A 241
LEU A  26
VAL A 137
ALA A 134
PHE A 264
 None
None
None
None
AKG  A 902 (-4.9A)
 1.30A 3n23C-1e5iA:
undetectable		 3n23C-1e5iA:
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.
3O5R_A_FK5A1001_1
(PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP5)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		5 / 11 TYR A 122
PHE A 161
VAL A  51
ILE A  50
TRP A 119
 None
 1.16A 3o5rA-1e5iA:
undetectable		 3o5rA-1e5iA:
18.21
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.
4AX8_A_SAMA1474_1
(WBDD)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		4 / 6 ARG A 266
ASP A 107
GLU A 116
LEU A 158
 None
 1.19A 4ax8A-1e5iA:
0.0		 4ax8A-1e5iA:
18.37
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.
4EIL_E_FOLE703_0
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		5 / 11 VAL A 137
PHE A 264
LEU A 191
VAL A 133
THR A 234
 None
AKG  A 902 (-4.9A)
None
None
None
 1.35A 4eilE-1e5iA:
undetectable		 4eilE-1e5iA:
20.11
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.
5D4U_B_SAMB301_0
(UNCHARACTERIZED
PROTEIN MJ0489)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		5 / 12 GLY A 227
LEU A 232
LEU A 191
GLY A 235
PHE A 152
 None
 1.08A 5d4uB-1e5iA:
undetectable		 5d4uB-1e5iA:
20.25
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.
5ECO_A_LEUA602_0
(JASMONIC ACID-AMIDO
SYNTHETASE JAR1)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		4 / 6 THR A 272
ALA A 292
THR A 291
VAL A 275
 None
 0.78A 5ecoA-1e5iA:
undetectable		 5ecoA-1e5iA:
23.51
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.
5LF7_K_6V8K305_0
(PROTEASOME SUBUNIT
BETA TYPE-1
PROTEASOME SUBUNIT
BETA TYPE-5)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		5 / 11 ALA A 230
ALA A 228
VAL A 137
GLY A 235
GLY A 236
 None
 0.94A 5lf7K-1e5iA:
undetectable
5lf7L-1e5iA:
undetectable		 5lf7K-1e5iA:
23.51
5lf7L-1e5iA:
20.67
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.
5LF7_Y_6V8Y306_0
(PROTEASOME SUBUNIT
BETA TYPE-1
PROTEASOME SUBUNIT
BETA TYPE-5)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		5 / 11 ALA A 230
ALA A 228
VAL A 137
GLY A 235
GLY A 236
 None
 0.95A 5lf7Y-1e5iA:
undetectable
5lf7Z-1e5iA:
undetectable		 5lf7Y-1e5iA:
23.51
5lf7Z-1e5iA:
20.67
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.
6CZM_D_HISD402_0
(ATP
PHOSPHORIBOSYLTRANSF
ERASE CATALYTIC
SUBUNIT)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		4 / 8 GLY A  38
LEU A  39
VAL A 224
LEU A 191
 None
 0.82A 6czmD-1e5iA:
0.0
6czmF-1e5iA:
0.0		 6czmD-1e5iA:
22.44
6czmF-1e5iA:
22.44
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.
6DEB_B_MTXB302_1
(BIFUNCTIONAL PROTEIN
FOLD)		 1e5i DEACETOXYCEPHALOSPOR
IN C SYNTHASE
(Streptomyces
clavuligerus) 		5 / 12 LEU A 215
PRO A 216
PHE A 225
ILE A 192
VAL A 262
 None
None
None
AKG  A 902 ( 4.6A)
AKG  A 902 ( 4.8A)
 1.25A 6debB-1e5iA:
undetectable		 6debB-1e5iA:
13.85