SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4k49'

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.
2BXM_A_IMNA2002_1
(SERUM ALBUMIN)		 4k49 ESTERASE YDII
(Escherichia
coli) 		5 / 11 ARG C  94
LEU C  53
ARG C  91
GLY C 123
LYS C 122
 None
None
HFQ  C 201 (-3.8A)
None
None
 1.25A 2bxmA-4k49C:
undetectable		 2bxmA-4k49C:
11.79
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.
2FB2_A_SAMA501_0
(MOLYBDENUM COFACTOR
BIOSYNTHESIS PROTEIN
A)		 4k49 ESTERASE YDII
(Escherichia
coli) 		4 / 8 CYH C 102
THR C 133
GLU C  63
THR C 132
 None
 1.12A 2fb2A-4k49C:
undetectable		 2fb2A-4k49C:
18.26
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.
2YA7_A_ZMRA1776_2
(NEURAMINIDASE A)		 4k49 ESTERASE YDII
(Escherichia
coli) 		4 / 6 ASP C  25
ILE C  26
LEU C  61
GLU C  29
 None
 1.08A 2ya7A-4k49C:
undetectable		 2ya7A-4k49C:
14.78
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.
2YA7_B_ZMRB1776_2
(NEURAMINIDASE A)		 4k49 ESTERASE YDII
(Escherichia
coli) 		4 / 6 ASP C  25
ILE C  26
LEU C  61
GLU C  29
 None
 1.07A 2ya7B-4k49C:
undetectable		 2ya7B-4k49C:
14.78
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.
3AG4_J_CHDJ60_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1)		 4k49 ESTERASE YDII
(Escherichia
coli) 		4 / 5 ARG C  27
MET C  40
THR C  39
LEU C  61
 None
 1.45A 3ag4J-4k49C:
undetectable		 3ag4J-4k49C:
16.91
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.
3FPJ_A_SAMA301_1
(PUTATIVE
UNCHARACTERIZED
PROTEIN)		 4k49 ESTERASE YDII
(Escherichia
coli) 		4 / 6 GLY C  96
THR C  46
GLU C 121
GLU C  37
 None
 0.90A 3fpjA-4k49C:
undetectable		 3fpjA-4k49C:
19.59
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.
3L35_H_DHIH3_0
(GP41 N-PEPTIDE
HIV ENTRY INHIBITOR
PIE12)		 4k49 ESTERASE YDII
(Escherichia
coli) 		3 / 3 LEU C 105
TRP C 114
GLY C  66
 None
 0.57A 3l35A-4k49C:
undetectable
3l35H-4k49C:
undetectable		 3l35A-4k49C:
16.91
3l35H-4k49C:
6.82
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.
3L35_K_DHIK3_0
(GP41 N-PEPTIDE
HIV ENTRY INHIBITOR
PIE12)		 4k49 ESTERASE YDII
(Escherichia
coli) 		3 / 3 LEU C 105
TRP C 114
GLY C  66
 None
 0.58A 3l35B-4k49C:
undetectable
3l35K-4k49C:
undetectable		 3l35B-4k49C:
16.91
3l35K-4k49C:
6.82
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.
5HRQ_A_IPHA101_0
(INSULIN A-CHAIN
INSULIN B-CHAIN)		 4k49 ESTERASE YDII
(Escherichia
coli) 		4 / 5 CYH C 126
HIS C  54
LEU C  53
HIS C  89
 None
HFQ  C 201 (-3.7A)
None
HFQ  C 201 (-4.1A)
 1.43A 5hrqA-4k49C:
undetectable
5hrqB-4k49C:
undetectable
5hrqF-4k49C:
undetectable		 5hrqA-4k49C:
11.36
5hrqB-4k49C:
17.24
5hrqF-4k49C:
17.24
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.
5HRQ_G_IPHG101_0
(INSULIN A-CHAIN
INSULIN B-CHAIN)		 4k49 ESTERASE YDII
(Escherichia
coli) 		4 / 6 HIS C  89
CYH C 126
HIS C  54
LEU C  53
 HFQ  C 201 (-4.1A)
None
HFQ  C 201 (-3.7A)
None
 1.47A 5hrqD-4k49C:
undetectable
5hrqG-4k49C:
undetectable
5hrqH-4k49C:
undetectable		 5hrqD-4k49C:
17.24
5hrqG-4k49C:
11.36
5hrqH-4k49C:
17.24
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.
5HRQ_K_IPHK101_0
(INSULIN A-CHAIN
INSULIN B-CHAIN)		 4k49 ESTERASE YDII
(Escherichia
coli) 		4 / 6 HIS C  89
CYH C 126
HIS C  54
LEU C  53
 HFQ  C 201 (-4.1A)
None
HFQ  C 201 (-3.7A)
None
 1.45A 5hrqH-4k49C:
undetectable
5hrqK-4k49C:
undetectable
5hrqL-4k49C:
undetectable		 5hrqH-4k49C:
17.24
5hrqK-4k49C:
11.36
5hrqL-4k49C:
17.24
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.
5WAU_J_CHDJ101_1
(CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 4k49 ESTERASE YDII
(Escherichia
coli) 		4 / 5 ARG C  27
MET C  40
THR C  39
LEU C  61
 None
 1.37A 5wauJ-4k49C:
undetectable		 5wauJ-4k49C:
16.91
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.
6DJZ_B_GMJB301_1
(SIGMA NON-OPIOID
INTRACELLULAR
RECEPTOR 1)		 4k49 ESTERASE YDII
(Escherichia
coli) 		4 / 6 GLN C 112
VAL C  80
GLU C  63
ALA C  87
 None
 1.26A 6djzB-4k49C:
undetectable		 6djzB-4k49C:
22.37
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.
6HU9_E_PCFE202_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 5A,
MITOCHONDRIAL
CYTOCHROME C OXIDASE
SUBUNIT 1)		 4k49 ESTERASE YDII
(Escherichia
coli) 		4 / 8 GLN C  78
ILE C   2
ALA C  69
VAL C  68
 None
 1.04A 6hu9a-4k49C:
undetectable
6hu9e-4k49C:
undetectable		 6hu9a-4k49C:
11.99
6hu9e-4k49C:
19.86