SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4o4f'

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.
1DF7_A_MTXA501_2
(DIHYDROFOLATE
REDUCTASE)		 4o4f INOSITOL
HEXAKISPHOSPHATE
KINASE
(Entamoeba
histolytica) 		3 / 3 TRP A  58
ARG A  84
THR A  59
 None
 0.96A 1df7A-4o4fA:
undetectable		 1df7A-4o4fA:
18.80
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.
2ZXW_P_CHDP1271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 4o4f INOSITOL
HEXAKISPHOSPHATE
KINASE
(Entamoeba
histolytica) 		4 / 6 LEU A 191
GLN A 190
PHE A 187
LEU A 256
 None
 0.85A 2zxwP-4o4fA:
undetectable
2zxwW-4o4fA:
undetectable		 2zxwP-4o4fA:
21.40
2zxwW-4o4fA:
15.34
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.
3ADS_A_IMNA2_2
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 4o4f INOSITOL
HEXAKISPHOSPHATE
KINASE
(Entamoeba
histolytica) 		4 / 6 ILE A 169
ILE A 142
LEU A 100
MET A 138
 None
 1.06A 3adsA-4o4fA:
undetectable		 3adsA-4o4fA:
23.18
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.
3AG1_C_CHDC271_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 4o4f INOSITOL
HEXAKISPHOSPHATE
KINASE
(Entamoeba
histolytica) 		4 / 6 LEU A 191
GLN A 190
PHE A 187
LEU A 256
 None
 0.80A 3ag1C-4o4fA:
2.0
3ag1J-4o4fA:
undetectable		 3ag1C-4o4fA:
21.40
3ag1J-4o4fA:
15.34
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.
3IJD_A_C2FA314_0
(UNCHARACTERIZED
PROTEIN)		 4o4f INOSITOL
HEXAKISPHOSPHATE
KINASE
(Entamoeba
histolytica) 		5 / 12 LEU A 191
VAL A 133
GLY A 132
LEU A 260
ILE A 263
 None
 1.11A 3ijdA-4o4fA:
undetectable		 3ijdA-4o4fA:
23.40
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.
3IJD_B_C2FB314_0
(UNCHARACTERIZED
PROTEIN)		 4o4f INOSITOL
HEXAKISPHOSPHATE
KINASE
(Entamoeba
histolytica) 		5 / 12 LEU A 191
VAL A 133
GLY A 132
LEU A 260
ILE A 263
 None
 1.13A 3ijdB-4o4fA:
undetectable		 3ijdB-4o4fA:
23.40
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.
3X2Q_P_CHDP307_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 4o4f INOSITOL
HEXAKISPHOSPHATE
KINASE
(Entamoeba
histolytica) 		4 / 7 LEU A 191
GLN A 190
PHE A 187
LEU A 256
 None
 0.86A 3x2qP-4o4fA:
undetectable
3x2qW-4o4fA:
undetectable		 3x2qP-4o4fA:
21.40
3x2qW-4o4fA:
15.34
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4O4D_A_ACTA406_0
(INOSITOL
HEXAKISPHOSPHATE
KINASE)		 4o4f INOSITOL
HEXAKISPHOSPHATE
KINASE
(Entamoeba
histolytica) 		7 / 7 TRP A 107
ASP A 108
THR A 111
ARG A 119
PHE A 206
SER A 207
HIS A 234
 None
None
None
IHP  A 403 (-3.1A)
None
MG  A 402 ( 4.5A)
None
 0.68A 4o4dA-4o4fA:
40.9		 4o4dA-4o4fA:
100.00
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.
4YJI_A_TYLA502_1
(ARYL ACYLAMIDASE)		 4o4f INOSITOL
HEXAKISPHOSPHATE
KINASE
(Entamoeba
histolytica) 		4 / 7 LEU A 165
THR A 127
GLY A 132
GLY A 103
 None
 0.73A 4yjiA-4o4fA:
undetectable		 4yjiA-4o4fA:
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.
5CDP_H_EVPH2101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B)		 4o4f INOSITOL
HEXAKISPHOSPHATE
KINASE
(Entamoeba
histolytica) 		4 / 6 SER A 136
GLY A 248
ASP A 247
GLY A 252
 IHP  A 403 ( 4.3A)
PO4  A 406 (-3.7A)
PO4  A 406 (-2.9A)
None
 0.77A 5cdpA-4o4fA:
1.8
5cdpB-4o4fA:
undetectable		 5cdpA-4o4fA:
20.20
5cdpB-4o4fA:
20.68
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.
5NZX_A_9F2A1102_1
(DNA CROSS-LINK
REPAIR 1A PROTEIN)		 4o4f INOSITOL
HEXAKISPHOSPHATE
KINASE
(Entamoeba
histolytica) 		4 / 8 PHE A 232
THR A  61
ILE A  64
GLY A  62
 None
 0.91A 5nzxA-4o4fA:
undetectable		 5nzxA-4o4fA:
21.90
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.
5NZY_A_CE3A1102_1
(DNA CROSS-LINK
REPAIR 1A PROTEIN)		 4o4f INOSITOL
HEXAKISPHOSPHATE
KINASE
(Entamoeba
histolytica) 		4 / 7 PHE A 232
THR A  61
ILE A  64
GLY A  62
 None
 0.97A 5nzyA-4o4fA:
undetectable		 5nzyA-4o4fA:
21.90
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.
5ZCQ_C_CHDC306_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 4o4f INOSITOL
HEXAKISPHOSPHATE
KINASE
(Entamoeba
histolytica) 		4 / 7 LEU A 191
GLN A 190
PHE A 187
LEU A 256
 None
 0.82A 5zcqC-4o4fA:
undetectable
5zcqJ-4o4fA:
undetectable		 5zcqC-4o4fA:
21.40
5zcqJ-4o4fA:
15.34
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.
6MN5_A_LLLA301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 4o4f INOSITOL
HEXAKISPHOSPHATE
KINASE
(Entamoeba
histolytica) 		4 / 6 ASP A 231
ASP A 108
CYH A 243
GLU A 110
 MG  A 402 ( 2.8A)
None
None
None
 1.29A 6mn5A-4o4fA:
undetectable		 6mn5A-4o4fA:
18.22
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.
6MN5_B_LLLB301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 4o4f INOSITOL
HEXAKISPHOSPHATE
KINASE
(Entamoeba
histolytica) 		4 / 7 ASP A 231
ASP A 108
CYH A 243
GLU A 110
 MG  A 402 ( 2.8A)
None
None
None
 1.32A 6mn5B-4o4fA:
undetectable		 6mn5B-4o4fA:
18.22
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.
6MN5_C_LLLC301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 4o4f INOSITOL
HEXAKISPHOSPHATE
KINASE
(Entamoeba
histolytica) 		4 / 6 ASP A 231
ASP A 108
CYH A 243
GLU A 110
 MG  A 402 ( 2.8A)
None
None
None
 1.15A 6mn5C-4o4fA:
undetectable		 6mn5C-4o4fA:
18.22
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.
6MN5_D_LLLD301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 4o4f INOSITOL
HEXAKISPHOSPHATE
KINASE
(Entamoeba
histolytica) 		4 / 6 ASP A 231
ASP A 108
CYH A 243
GLU A 110
 MG  A 402 ( 2.8A)
None
None
None
 1.13A 6mn5D-4o4fA:
undetectable		 6mn5D-4o4fA:
18.22