SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4gul'

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.
1DHF_B_FOLB187_0
(DIHYDROFOLATE
REDUCTASE)		 4gul PIRIN
(Homo
sapiens) 		5 / 12 ILE A 152
PHE A  42
ILE A 197
LEU A  68
THR A 169
 None
 0.93A 1dhfB-4gulA:
undetectable		 1dhfB-4gulA:
22.81
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.
1S9P_D_DESD600_1
(ESTROGEN-RELATED
RECEPTOR GAMMA)		 4gul PIRIN
(Homo
sapiens) 		5 / 12 LEU A 116
LEU A 246
VAL A 250
LEU A  36
ILE A 241
 None
 1.09A 1s9pD-4gulA:
undetectable		 1s9pD-4gulA:
20.07
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.
1TV8_A_SAMA1501_0
(MOLYBDENUM COFACTOR
BIOSYNTHESIS PROTEIN
A)		 4gul PIRIN
(Homo
sapiens) 		4 / 7 THR A 169
GLU A 244
THR A 167
VAL A 250
 None
 1.12A 1tv8A-4gulA:
undetectable		 1tv8A-4gulA:
21.51
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.
1TV8_B_SAMB2501_0
(MOLYBDENUM COFACTOR
BIOSYNTHESIS PROTEIN
A)		 4gul PIRIN
(Homo
sapiens) 		4 / 7 THR A 169
GLU A 244
THR A 167
VAL A 250
 None
 1.12A 1tv8B-4gulA:
undetectable		 1tv8B-4gulA:
21.51
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.
2FB2_A_SAMA501_0
(MOLYBDENUM COFACTOR
BIOSYNTHESIS PROTEIN
A)		 4gul PIRIN
(Homo
sapiens) 		4 / 8 THR A 169
GLU A 244
THR A 167
VAL A 250
 None
 1.12A 2fb2A-4gulA:
undetectable		 2fb2A-4gulA:
21.67
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_B_SAMB501_0
(MOLYBDENUM COFACTOR
BIOSYNTHESIS PROTEIN
A)		 4gul PIRIN
(Homo
sapiens) 		4 / 7 THR A 169
GLU A 244
THR A 167
VAL A 250
 None
 1.07A 2fb2B-4gulA:
undetectable		 2fb2B-4gulA:
21.67
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.
3DAT_A_MTXA201_1
(DIHYDROFOLATE
REDUCTASE)		 4gul PIRIN
(Homo
sapiens) 		5 / 12 ALA A 218
LEU A 220
GLN A 209
VAL A 201
PHE A 238
 None
 1.11A 3datA-4gulA:
undetectable		 3datA-4gulA:
21.92
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.
3UFN_A_ROCA401_2
(HIV-1 PROTEASE)		 4gul PIRIN
(Homo
sapiens) 		4 / 7 GLY A  29
ILE A  28
VAL A 250
VAL A 257
 None
 0.74A 3ufnB-4gulA:
undetectable		 3ufnB-4gulA:
17.34
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.
3W68_C_VIVC301_0
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN)		 4gul PIRIN
(Homo
sapiens) 		5 / 12 VAL A 228
ILE A  28
VAL A   7
LEU A 220
VAL A 226
 None
 1.20A 3w68C-4gulA:
undetectable		 3w68C-4gulA:
21.64
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.
4FFW_A_715A801_2
(DIPEPTIDYL PEPTIDASE
4)		 4gul PIRIN
(Homo
sapiens) 		3 / 3 PHE A  42
TYR A  66
TYR A 171
 None
 1.04A 4ffwA-4gulA:
undetectable		 4ffwA-4gulA:
17.53
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.
4KEB_B_FOLB202_0
(DIHYDROFOLATE
REDUCTASE)		 4gul PIRIN
(Homo
sapiens) 		5 / 12 ILE A 152
PHE A  42
ILE A 197
LEU A  68
THR A 169
 None
 0.97A 4kebB-4gulA:
undetectable		 4kebB-4gulA:
22.81
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.
4KFJ_B_FOLB202_0
(DIHYDROFOLATE
REDUCTASE)		 4gul PIRIN
(Homo
sapiens) 		5 / 12 ILE A 152
PHE A  42
ILE A 197
LEU A  68
THR A 169
 None
 0.98A 4kfjB-4gulA:
undetectable		 4kfjB-4gulA:
22.81
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.
4KRH_A_SAMA900_0
(PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE
2)		 4gul PIRIN
(Homo
sapiens) 		5 / 12 GLY A  52
GLY A  21
ASP A  55
ALA A 102
ILE A 288
 None
 1.01A 4krhA-4gulA:
undetectable		 4krhA-4gulA:
20.93
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.
4LTW_A_486A303_1
(ANCESTRAL STEROID
RECEPTOR 2)		 4gul PIRIN
(Homo
sapiens) 		5 / 9 LEU A 116
LEU A  36
PHE A 193
TYR A 195
LEU A 114
 None
 1.41A 4ltwA-4gulA:
undetectable		 4ltwA-4gulA:
20.27
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.
4M6K_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 4gul PIRIN
(Homo
sapiens) 		5 / 12 ILE A 152
PHE A  42
ILE A 197
LEU A  68
THR A 169
 None
 1.02A 4m6kA-4gulA:
undetectable		 4m6kA-4gulA:
22.81
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.
4XIW_B_AZMB402_1
(CARBONIC ANHYDRASE,
ALPHA TYPE)		 4gul PIRIN
(Homo
sapiens) 		5 / 12 HIS A 101
GLU A 103
HIS A  56
THR A  63
VAL A 257
 FE  A1001 (-3.3A)
FE  A1001 (-3.0A)
FE  A1001 (-3.4A)
FE  A1001 ( 4.8A)
None
 1.05A 4xiwB-4gulA:
undetectable
4xiwE-4gulA:
undetectable		 4xiwB-4gulA:
21.69
4xiwE-4gulA:
21.69
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.
5ZRD_A_CUA607_0
(TYROSINASE)		 4gul PIRIN
(Homo
sapiens) 		3 / 3 HIS A  56
HIS A 101
HIS A  58
 FE  A1001 (-3.4A)
FE  A1001 (-3.3A)
FE  A1001 (-3.4A)
 0.51A 5zrdA-4gulA:
undetectable		 5zrdA-4gulA:
19.09