SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4bwr'

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.
1FBY_A_9CRA500_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 4bwr PROTEIN
CORRESPONDING TO
LOCUS C5321 FROM
CFT073 E.COLI STRAIN
(Escherichia
coli) 		5 / 12 ALA A  46
ALA A  47
GLN A  49
LEU A  20
ALA A  16
 None
 1.05A 1fbyA-4bwrA:
undetectable		 1fbyA-4bwrA:
18.63
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.
1FBY_B_9CRB1500_1
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 4bwr PROTEIN
CORRESPONDING TO
LOCUS C5321 FROM
CFT073 E.COLI STRAIN
(Escherichia
coli) 		5 / 12 ALA A  46
ALA A  47
GLN A  49
LEU A  20
ALA A  16
 None
 1.03A 1fbyB-4bwrA:
undetectable		 1fbyB-4bwrA:
18.63
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.
2CL5_B_SAMB1217_1
(CATECHOL
O-METHYLTRANSFERASE)		 4bwr PROTEIN
CORRESPONDING TO
LOCUS C5321 FROM
CFT073 E.COLI STRAIN
(Escherichia
coli) 		4 / 6 SER A 219
TYR A 240
SER A 232
ASP A 204
 None
EDO  A1494 (-3.9A)
EDO  A1493 ( 3.7A)
None
 1.30A 2cl5B-4bwrA:
undetectable		 2cl5B-4bwrA:
16.60
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.
2GSS_A_EAAA0_1
(GLUTATHIONE
S-TRANSFERASE P1-1)		 4bwr PROTEIN
CORRESPONDING TO
LOCUS C5321 FROM
CFT073 E.COLI STRAIN
(Escherichia
coli) 		4 / 8 PHE A 414
VAL A 380
ILE A 421
GLY A 415
 EDO  A1490 (-4.7A)
None
EDO  A1477 (-3.3A)
None
 0.93A 2gssA-4bwrA:
undetectable		 2gssA-4bwrA:
19.58
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.
2GSS_B_EAAB0_1
(GLUTATHIONE
S-TRANSFERASE P1-1)		 4bwr PROTEIN
CORRESPONDING TO
LOCUS C5321 FROM
CFT073 E.COLI STRAIN
(Escherichia
coli) 		4 / 8 PHE A 414
VAL A 380
ILE A 421
GLY A 415
 EDO  A1490 (-4.7A)
None
EDO  A1477 (-3.3A)
None
 0.93A 2gssB-4bwrA:
undetectable		 2gssB-4bwrA:
19.58
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.
2OTH_A_NIMA300_1
(PHOSPHOLIPASE A2
VRV-PL-VIIIA)		 4bwr PROTEIN
CORRESPONDING TO
LOCUS C5321 FROM
CFT073 E.COLI STRAIN
(Escherichia
coli) 		4 / 5 LEU A 197
ALA A 234
ILE A 233
SER A 232
 None
None
None
EDO  A1493 ( 3.7A)
 0.99A 2othA-4bwrA:
undetectable		 2othA-4bwrA:
14.47
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.
2ZVJ_A_SAMA301_1
(CATECHOL
O-METHYLTRANSFERASE)		 4bwr PROTEIN
CORRESPONDING TO
LOCUS C5321 FROM
CFT073 E.COLI STRAIN
(Escherichia
coli) 		4 / 6 SER A 219
TYR A 240
SER A 232
ASP A 204
 None
EDO  A1494 (-3.9A)
EDO  A1493 ( 3.7A)
None
 1.29A 2zvjA-4bwrA:
undetectable		 2zvjA-4bwrA:
16.60
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.
3HUO_A_PNNA303_0
(CTX-M-9
EXTENDED-SPECTRUM
BETA-LACTAMASE)		 4bwr PROTEIN
CORRESPONDING TO
LOCUS C5321 FROM
CFT073 E.COLI STRAIN
(Escherichia
coli) 		4 / 4 GLN A 225
GLN A 199
GLY A 198
HIS A 201
 None
 1.44A 3huoA-4bwrA:
undetectable		 3huoA-4bwrA:
22.47
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.
3N9J_A_EAAA210_1
(GLUTATHIONE
S-TRANSFERASE P)		 4bwr PROTEIN
CORRESPONDING TO
LOCUS C5321 FROM
CFT073 E.COLI STRAIN
(Escherichia
coli) 		4 / 8 PHE A 414
VAL A 380
ILE A 421
GLY A 415
 EDO  A1490 (-4.7A)
None
EDO  A1477 (-3.3A)
None
 0.93A 3n9jA-4bwrA:
undetectable		 3n9jA-4bwrA:
19.58
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.
3UT5_B_LOCB502_1
(TUBULIN BETA CHAIN)		 4bwr PROTEIN
CORRESPONDING TO
LOCUS C5321 FROM
CFT073 E.COLI STRAIN
(Escherichia
coli) 		5 / 12 LEU A  84
ALA A  82
LEU A  94
ASN A  93
ILE A  77
 None
 1.17A 3ut5B-4bwrA:
undetectable		 3ut5B-4bwrA:
22.83
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.
3V3N_B_MIYB2001_1
(TETX2 PROTEIN)		 4bwr PROTEIN
CORRESPONDING TO
LOCUS C5321 FROM
CFT073 E.COLI STRAIN
(Escherichia
coli) 		4 / 8 GLN A  92
ARG A 116
GLY A 126
GLY A 139
 None
None
None
EDO  A1487 ( 4.8A)
 0.90A 3v3nB-4bwrA:
undetectable		 3v3nB-4bwrA:
22.18
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.
3V3N_C_MIYC2001_1
(TETX2 PROTEIN)		 4bwr PROTEIN
CORRESPONDING TO
LOCUS C5321 FROM
CFT073 E.COLI STRAIN
(Escherichia
coli) 		4 / 8 GLN A  92
ARG A 116
GLY A 126
GLY A 139
 None
None
None
EDO  A1487 ( 4.8A)
 0.89A 3v3nC-4bwrA:
undetectable		 3v3nC-4bwrA:
22.18
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.
5FHR_A_SAMA303_1
(CATECHOL
O-METHYLTRANSFERASE)		 4bwr PROTEIN
CORRESPONDING TO
LOCUS C5321 FROM
CFT073 E.COLI STRAIN
(Escherichia
coli) 		4 / 5 SER A 219
TYR A 240
SER A 232
ASP A 204
 None
EDO  A1494 (-3.9A)
EDO  A1493 ( 3.7A)
None
 1.26A 5fhrA-4bwrA:
undetectable		 5fhrA-4bwrA:
16.77
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.
6NMP_P_CHDP307_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 4bwr PROTEIN
CORRESPONDING TO
LOCUS C5321 FROM
CFT073 E.COLI STRAIN
(Escherichia
coli) 		4 / 5 ARG A 332
LEU A 346
GLN A 343
PHE A 344
 None
 1.36A 6nmpP-4bwrA:
undetectable
6nmpW-4bwrA:
undetectable		 6nmpP-4bwrA:
17.16
6nmpW-4bwrA:
8.57