SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'BIX'


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.
1K4T_D_TTCD990_1
(DNA TOPOISOMERASE I)		 3fed GLUTAMATE
CARBOXYPEPTIDASE III
(Homo
sapiens) 		4 / 5 GLU A 415
ARG A 524
ASP A 455
THR A 528
 ZN  A1751 ( 1.9A)
BIX  A   1 ( 3.1A)
None
None
 1.04A 1k4tA-3fedA:
undetectable		 1k4tA-3fedA:
23.65
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.
1NX9_A_AICA5001_1
(ALPHA-AMINO ACID
ESTER HYDROLASE)		 3fed GLUTAMATE
CARBOXYPEPTIDASE III
(Homo
sapiens) 		4 / 8 TYR A 542
TYR A 224
GLU A 547
HIS A 367
 BIX  A   1 (-4.7A)
None
None
ZN  A1752 ( 3.3A)
 1.11A 1nx9A-3fedA:
3.2		 1nx9A-3fedA:
21.34
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.
1NX9_B_AICB5002_1
(ALPHA-AMINO ACID
ESTER HYDROLASE)		 3fed GLUTAMATE
CARBOXYPEPTIDASE III
(Homo
sapiens) 		4 / 8 TYR A 542
TYR A 224
GLU A 547
HIS A 367
 BIX  A   1 (-4.7A)
None
None
ZN  A1752 ( 3.3A)
 1.12A 1nx9B-3fedA:
3.4		 1nx9B-3fedA:
21.34
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.
1NX9_C_AICC5003_1
(ALPHA-AMINO ACID
ESTER HYDROLASE)		 3fed GLUTAMATE
CARBOXYPEPTIDASE III
(Homo
sapiens) 		4 / 8 TYR A 542
TYR A 224
GLU A 547
HIS A 367
 BIX  A   1 (-4.7A)
None
None
ZN  A1752 ( 3.3A)
 1.11A 1nx9C-3fedA:
3.7		 1nx9C-3fedA:
21.34
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.
1NX9_D_AICD5004_1
(ALPHA-AMINO ACID
ESTER HYDROLASE)		 3fed GLUTAMATE
CARBOXYPEPTIDASE III
(Homo
sapiens) 		4 / 8 TYR A 542
TYR A 224
GLU A 547
HIS A 367
 BIX  A   1 (-4.7A)
None
None
ZN  A1752 ( 3.3A)
 1.13A 1nx9D-3fedA:
2.9		 1nx9D-3fedA:
21.34
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.
1RR8_A_TTCA100_1
(DNA TOPOISOMERASE I)		 3fed GLUTAMATE
CARBOXYPEPTIDASE III
(Homo
sapiens) 		4 / 5 GLU A 415
ARG A 524
ASP A 455
THR A 528
 ZN  A1751 ( 1.9A)
BIX  A   1 ( 3.1A)
None
None
 1.13A 1rr8C-3fedA:
undetectable		 1rr8C-3fedA:
24.14
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.
1RRJ_B_TTCB990_1
(DNA TOPOISOMERASE I)		 3fed GLUTAMATE
CARBOXYPEPTIDASE III
(Homo
sapiens) 		4 / 5 GLU A 415
ARG A 524
ASP A 455
THR A 528
 ZN  A1751 ( 1.9A)
BIX  A   1 ( 3.1A)
None
None
 1.09A 1rrjA-3fedA:
0.0		 1rrjA-3fedA:
24.27
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.
2XF3_B_J01B600_1
(ORF12)		 3fed GLUTAMATE
CARBOXYPEPTIDASE III
(Homo
sapiens) 		5 / 11 SER A 509
TYR A 542
GLY A 508
PHE A 199
ARG A 200
 ZN  A1752 ( 4.9A)
BIX  A   1 (-4.7A)
BIX  A   1 (-3.4A)
BIX  A   1 ( 4.8A)
BIX  A   1 (-2.7A)
 1.22A 2xf3B-3fedA:
undetectable		 2xf3B-3fedA:
21.67
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.
2XH9_B_J01B1437_1
(ORF12)		 3fed GLUTAMATE
CARBOXYPEPTIDASE III
(Homo
sapiens) 		5 / 10 SER A 509
TYR A 542
GLY A 508
PHE A 199
ARG A 200
 ZN  A1752 ( 4.9A)
BIX  A   1 (-4.7A)
BIX  A   1 (-3.4A)
BIX  A   1 ( 4.8A)
BIX  A   1 (-2.7A)
 1.23A 2xh9B-3fedA:
undetectable		 2xh9B-3fedA:
21.67
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.
3E9X_A_NIMA1_1
(LACTOTRANSFERRIN')		 3fed GLUTAMATE
CARBOXYPEPTIDASE III
(Homo
sapiens) 		4 / 4 GLU A 414
GLY A 420
THR A 422
GLU A 423
 BIX  A   1 ( 2.7A)
None
None
CA  A1755 (-2.2A)
 1.01A 3e9xA-3fedA:
undetectable		 3e9xA-3fedA:
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.
4NTX_A_AMRA509_1
(ACID-SENSING ION
CHANNEL 1
BASIC PHOSPHOLIPASE
A2 HOMOLOG TX-BETA)		 3fed GLUTAMATE
CARBOXYPEPTIDASE III
(Homo
sapiens) 		4 / 6 GLU A 447
ASP A 377
GLU A 414
ARG A 200
 None
ZN  A1751 (-2.5A)
BIX  A   1 ( 2.7A)
BIX  A   1 (-2.7A)
 0.96A 4ntxA-3fedA:
2.8
4ntxC-3fedA:
undetectable		 4ntxA-3fedA:
21.52
4ntxC-3fedA:
9.97
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.
4PQA_A_X8ZA401_1
(SUCCINYL-DIAMINOPIME
LATE DESUCCINYLASE)		 3fed GLUTAMATE
CARBOXYPEPTIDASE III
(Homo
sapiens) 		5 / 11 HIS A 367
ASP A 377
GLU A 414
GLU A 415
HIS A 543
 ZN  A1752 ( 3.3A)
ZN  A1751 (-2.5A)
BIX  A   1 ( 2.7A)
ZN  A1751 ( 1.9A)
ZN  A1751 ( 3.2A)
 0.44A 4pqaA-3fedA:
19.5		 4pqaA-3fedA:
21.30
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.
6DWN_A_AQ4A602_0
(CYTOCHROME P450 1A1)		 3fed GLUTAMATE
CARBOXYPEPTIDASE III
(Homo
sapiens) 		5 / 12 SER A 421
ASN A 250
ASN A 247
ASP A 510
GLY A 508
 None
None
BIX  A   1 (-3.2A)
None
BIX  A   1 (-3.4A)
 1.17A 6dwnA-3fedA:
undetectable		 6dwnA-3fedA:
9.22