SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2qfl'

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.
1WRL_B_TFPB203_1
(TROPONIN C, SLOW
SKELETAL AND CARDIAC
MUSCLES)		 2qfl INOSITOL-1-MONOPHOSP
HATASE
(Escherichia
coli) 		4 / 6 PHE A  92
VAL A  43
PHE A  99
MET A 120
 None
 0.95A 1wrlB-2qflA:
undetectable		 1wrlB-2qflA:
18.42
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.
2J9C_C_ACTC1120_0
(HYPOTHETICAL
NITROGEN REGULATORY
PII-LIKE PROTEIN
MJ0059)		 2qfl INOSITOL-1-MONOPHOSP
HATASE
(Escherichia
coli) 		3 / 3 LYS A   1
TYR A  59
PRO A   3
 None
 0.97A 2j9cC-2qflA:
0.8		 2j9cC-2qflA:
21.79
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.
2NYU_B_SAMB201_0
(PUTATIVE RIBOSOMAL
RNA
METHYLTRANSFERASE 2)		 2qfl INOSITOL-1-MONOPHOSP
HATASE
(Escherichia
coli) 		5 / 12 GLY A 132
ALA A 223
GLY A 224
LEU A 140
LEU A   5
 None
 1.04A 2nyuB-2qflA:
undetectable		 2nyuB-2qflA:
19.41
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.
2OIP_B_MTXB609_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 2qfl INOSITOL-1-MONOPHOSP
HATASE
(Escherichia
coli) 		5 / 12 LEU A 208
ASP A 191
LEU A 192
TYR A 168
THR A 185
 None
 1.25A 2oipB-2qflA:
2.8		 2oipB-2qflA:
18.69
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.
2YVL_D_SAMD603_0
(HYPOTHETICAL PROTEIN)		 2qfl INOSITOL-1-MONOPHOSP
HATASE
(Escherichia
coli) 		5 / 12 GLY A  88
GLY A 186
LEU A 190
PHE A  92
ASP A  87
 ACT  A 375 (-3.7A)
EEE  A 376 (-4.2A)
None
None
EEE  A 376 (-2.7A)
 1.09A 2yvlD-2qflA:
undetectable		 2yvlD-2qflA:
21.20
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.
3NDV_A_AICA375_1
(BETA-PEPTIDYL
AMINOPEPTIDASE)		 2qfl INOSITOL-1-MONOPHOSP
HATASE
(Escherichia
coli) 		5 / 11 GLY A 202
THR A 151
ARG A 146
SER A 143
LEU A 153
 None
 1.39A 3ndvA-2qflA:
undetectable
3ndvB-2qflA:
undetectable		 3ndvA-2qflA:
21.52
3ndvB-2qflA:
21.52
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.
3NDV_D_AICD374_1
(BETA-PEPTIDYL
AMINOPEPTIDASE)		 2qfl INOSITOL-1-MONOPHOSP
HATASE
(Escherichia
coli) 		5 / 11 LEU A 153
GLY A 202
THR A 151
ARG A 146
SER A 143
 None
 1.38A 3ndvC-2qflA:
undetectable
3ndvD-2qflA:
undetectable		 3ndvC-2qflA:
21.52
3ndvD-2qflA:
21.52
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.
3WRK_A_CAMA502_0
(CAMPHOR
5-MONOOXYGENASE)		 2qfl INOSITOL-1-MONOPHOSP
HATASE
(Escherichia
coli) 		4 / 5 PHE A 230
GLY A 156
ILE A 171
VAL A 172
 None
 0.76A 3wrkA-2qflA:
undetectable		 3wrkA-2qflA:
20.14
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.
4BVA_B_T3B1314_1
(THIOMORPHOLINE-CARBO
XYLATE DEHYDROGENASE)		 2qfl INOSITOL-1-MONOPHOSP
HATASE
(Escherichia
coli) 		5 / 12 VAL A 195
PHE A 203
GLY A 245
VAL A 249
PHE A 204
 None
 1.35A 4bvaB-2qflA:
2.2		 4bvaB-2qflA:
22.29
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.
4NKX_A_STRA601_2
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)		 2qfl INOSITOL-1-MONOPHOSP
HATASE
(Escherichia
coli) 		4 / 6 LEU A 140
GLU A 222
VAL A 227
ALA A 244
 None
 0.99A 4nkxA-2qflA:
undetectable		 4nkxA-2qflA:
19.11
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.
4Q0D_C_MTXC604_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 2qfl INOSITOL-1-MONOPHOSP
HATASE
(Escherichia
coli) 		5 / 12 LEU A 208
ASP A 191
LEU A 192
TYR A 168
THR A 185
 None
 1.27A 4q0dC-2qflA:
undetectable		 4q0dC-2qflA:
18.39
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.
4Q0D_D_MTXD604_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 2qfl INOSITOL-1-MONOPHOSP
HATASE
(Escherichia
coli) 		5 / 12 LEU A 208
ASP A 191
LEU A 192
TYR A 168
THR A 185
 None
 1.27A 4q0dD-2qflA:
undetectable		 4q0dD-2qflA:
18.39
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.
4XJE_A_TOYA202_1
(AADB)		 2qfl INOSITOL-1-MONOPHOSP
HATASE
(Escherichia
coli) 		4 / 8 ASP A 212
ASP A  87
ASP A  84
ILE A  19
 EEE  A 376 ( 4.7A)
EEE  A 376 (-2.7A)
None
None
 1.02A 4xjeA-2qflA:
undetectable		 4xjeA-2qflA:
19.85
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.
5CFS_A_TOYA203_1
(AAD(2''),GENTAMICIN
2''-NUCLEOTIDYLTRANS
FERASE,GENTAMICIN
RESISTANCE PROTEIN)		 2qfl INOSITOL-1-MONOPHOSP
HATASE
(Escherichia
coli) 		4 / 8 ASP A 212
ASP A  87
ASP A  84
ILE A  19
 EEE  A 376 ( 4.7A)
EEE  A 376 (-2.7A)
None
None
 1.01A 5cfsA-2qflA:
undetectable		 5cfsA-2qflA:
19.85
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.
5IK1_A_CAMA503_0
(CAMPHOR
5-MONOOXYGENASE)		 2qfl INOSITOL-1-MONOPHOSP
HATASE
(Escherichia
coli) 		4 / 7 PHE A 230
GLY A 156
ILE A 171
VAL A 172
 None
 0.81A 5ik1A-2qflA:
undetectable		 5ik1A-2qflA:
20.05
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.
5L8D_B_ACTB601_0
(NICKEL-BINDING
PERIPLASMIC PROTEIN)		 2qfl INOSITOL-1-MONOPHOSP
HATASE
(Escherichia
coli) 		3 / 3 THR A  66
PRO A  85
ASP A  44
 None
 0.89A 5l8dB-2qflA:
1.9		 5l8dB-2qflA:
20.51
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.
5MWU_B_ACTB601_0
(NICKEL-BINDING
PERIPLASMIC PROTEIN)		 2qfl INOSITOL-1-MONOPHOSP
HATASE
(Escherichia
coli) 		3 / 3 THR A  66
PRO A  85
ASP A  44
 None
 0.89A 5mwuB-2qflA:
1.9		 5mwuB-2qflA:
20.51