SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2x56'

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.
1ERR_B_CCSB381_0
(ESTROGEN RECEPTOR)		 2x56 COAGULASE/FIBRINOLYS
IN
(Yersinia
pestis) 		3 / 3 GLU A 111
ALA A 109
SER A  74
 None
None
C8E  A1295 (-4.7A)
 0.38A 1errB-2x56A:
undetectable		 1errB-2x56A:
21.04
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)		 2x56 COAGULASE/FIBRINOLYS
IN
(Yersinia
pestis) 		4 / 8 ARG A 211
HIS A 101
SER A  99
TYR A 150
 None
 1.26A 1nx9A-2x56A:
undetectable		 1nx9A-2x56A:
17.02
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)		 2x56 COAGULASE/FIBRINOLYS
IN
(Yersinia
pestis) 		4 / 8 ARG A 211
HIS A 101
SER A  99
TYR A 150
 None
 1.29A 1nx9B-2x56A:
undetectable		 1nx9B-2x56A:
17.02
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)		 2x56 COAGULASE/FIBRINOLYS
IN
(Yersinia
pestis) 		4 / 8 ARG A 211
HIS A 101
SER A  99
TYR A 150
 None
 1.28A 1nx9C-2x56A:
undetectable		 1nx9C-2x56A:
17.02
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)		 2x56 COAGULASE/FIBRINOLYS
IN
(Yersinia
pestis) 		4 / 8 ARG A 211
HIS A 101
SER A  99
TYR A 150
 None
 1.28A 1nx9D-2x56A:
undetectable		 1nx9D-2x56A:
17.02
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.
1ZP4_A_C2FA995_0
(5,10-METHYLENETETRAH
YDROFOLATE REDUCTASE)		 2x56 COAGULASE/FIBRINOLYS
IN
(Yersinia
pestis) 		5 / 9 GLN A 182
ASP A  60
GLN A 289
THR A  15
LEU A 193
 None
 1.31A 1zp4A-2x56A:
0.0		 1zp4A-2x56A:
19.40
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.
2HA2_B_SCKB951_1
(ACETYLCHOLINESTERASE)		 2x56 COAGULASE/FIBRINOLYS
IN
(Yersinia
pestis) 		4 / 8 TYR A 176
ASP A 113
TRP A  72
TYR A 224
 None
 1.13A 2ha2B-2x56A:
undetectable		 2ha2B-2x56A:
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.
2YOE_C_FL7C1318_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 2x56 COAGULASE/FIBRINOLYS
IN
(Yersinia
pestis) 		4 / 8 ASN A 230
ASN A 191
ILE A   9
THR A  15
 None
 0.82A 2yoeB-2x56A:
undetectable
2yoeC-2x56A:
undetectable		 2yoeB-2x56A:
20.24
2yoeC-2x56A:
20.24
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.
3MBG_A_ACTA207_0
(FAD-LINKED
SULFHYDRYL OXIDASE
ALR)		 2x56 COAGULASE/FIBRINOLYS
IN
(Yersinia
pestis) 		4 / 7 LYS A 240
ASP A  56
THR A  15
ALA A  17
 None
 1.26A 3mbgA-2x56A:
undetectable
3mbgB-2x56A:
undetectable		 3mbgA-2x56A:
18.38
3mbgB-2x56A:
18.38
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.
3SG9_B_KANB305_1
(APH(2'')-ID)		 2x56 COAGULASE/FIBRINOLYS
IN
(Yersinia
pestis) 		4 / 8 ASP A  83
SER A 100
HIS A  98
ASP A  44
 None
 1.15A 3sg9B-2x56A:
undetectable		 3sg9B-2x56A:
21.56
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.
4GKH_K_KANK301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2x56 COAGULASE/FIBRINOLYS
IN
(Yersinia
pestis) 		4 / 8 ASP A 204
ASP A  86
GLU A 217
ASP A  84
 None
None
C8E  A1308 (-4.0A)
None
 1.03A 4gkhC-2x56A:
undetectable
4gkhK-2x56A:
undetectable		 4gkhC-2x56A:
23.78
4gkhK-2x56A:
23.78
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.
4GKI_G_KANG301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 2x56 COAGULASE/FIBRINOLYS
IN
(Yersinia
pestis) 		4 / 8 ASP A 204
ASP A  86
GLU A 217
ASP A  84
 None
None
C8E  A1308 (-4.0A)
None
 0.98A 4gkiE-2x56A:
undetectable
4gkiG-2x56A:
undetectable		 4gkiE-2x56A:
23.78
4gkiG-2x56A:
23.78
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.
4OBW_B_SAMB601_0
(2-METHOXY-6-POLYPREN
YL-1,4-BENZOQUINOL
METHYLASE,
MITOCHONDRIAL)		 2x56 COAGULASE/FIBRINOLYS
IN
(Yersinia
pestis) 		5 / 12 ASN A 115
GLY A  55
GLY A  71
GLY A 287
PHE A 242
 None
C8E  A1296 (-3.5A)
C8E  A1296 (-4.0A)
C8E  A1300 ( 4.3A)
None
 0.89A 4obwB-2x56A:
undetectable		 4obwB-2x56A:
19.80
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.
5KVA_A_SAMA301_1
(CAFFEOYL-COA
O-METHYLTRANSFERASE)		 2x56 COAGULASE/FIBRINOLYS
IN
(Yersinia
pestis) 		3 / 3 THR A  66
SER A  58
ASP A 113
 None
 0.74A 5kvaA-2x56A:
undetectable		 5kvaA-2x56A:
20.74
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.
5KVA_B_SAMB301_1
(CAFFEOYL-COA
O-METHYLTRANSFERASE)		 2x56 COAGULASE/FIBRINOLYS
IN
(Yersinia
pestis) 		3 / 3 THR A  66
SER A  58
ASP A 113
 None
 0.76A 5kvaB-2x56A:
undetectable		 5kvaB-2x56A:
20.74
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.
6MN4_B_AM2B301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 2x56 COAGULASE/FIBRINOLYS
IN
(Yersinia
pestis) 		4 / 8 ASP A  44
HIS A 208
HIS A  28
ASP A  86
 None
C8E  A1308 ( 4.4A)
None
None
 1.20A 6mn4B-2x56A:
undetectable		 6mn4B-2x56A:
22.59