SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'ICP'


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.
1HPV_B_478B200_1
(HIV-1 PROTEASE)		 1g67 THIAMIN PHOSPHATE
SYNTHASE
(Bacillus
subtilis) 		6 / 9 LEU A 170
GLY A 149
VAL A 197
ILE A 189
GLY A 187
ILE A 171
 None
ICP  A2001 (-3.6A)
None
None
TZP  A2005 ( 3.9A)
None
 1.49A 1hpvA-1g67A:
undetectable		 1hpvA-1g67A:
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.
1RS7_A_ACTA860_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 1g67 THIAMIN PHOSPHATE
SYNTHASE
(Bacillus
subtilis) 		4 / 5 GLY A 187
ILE A 186
VAL A 197
SER A 206
 TZP  A2005 ( 3.9A)
ICP  A2001 ( 3.7A)
None
ICP  A2001 ( 4.1A)
 1.23A 1rs7A-1g67A:
0.0		 1rs7A-1g67A:
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.
1XF1_A_ACTA1107_0
(C5A PEPTIDASE)		 1g67 THIAMIN PHOSPHATE
SYNTHASE
(Bacillus
subtilis) 		4 / 5 LEU A 127
GLY A 128
HIS A 107
ILE A 108
 None
None
ICP  A2001 ( 3.5A)
None
 0.93A 1xf1A-1g67A:
3.0		 1xf1A-1g67A:
14.24
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.
2TSR_B_D16B409_1
(THYMIDYLATE SYNTHASE)		 1g67 THIAMIN PHOSPHATE
SYNTHASE
(Bacillus
subtilis) 		5 / 8 ARG A  59
ILE A 186
ASP A 203
LEU A  26
GLY A 204
 POP  A2003 ( 3.9A)
ICP  A2001 ( 3.7A)
None
None
None
 1.49A 2tsrB-1g67A:
undetectable		 2tsrB-1g67A:
20.19
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.
3VRI_A_1KXA301_1
(HLA CLASS I
HISTOCOMPATIBILITY
ANTIGEN, B-57 ALPHA
CHAIN
10-MER PEPTIDE)		 1g67 THIAMIN PHOSPHATE
SYNTHASE
(Bacillus
subtilis) 		5 / 10 TYR A  29
VAL A 184
TYR A 147
ILE A 171
ILE A 153
 ICP  A2001 (-4.2A)
None
None
None
None
 1.35A 3vriA-1g67A:
undetectable
3vriC-1g67A:
undetectable		 3vriA-1g67A:
21.86
3vriC-1g67A:
4.60
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.
4S0V_A_SUVA2001_1
(HUMAN OREXIN
RECEPTOR TYPE 2
FUSION PROTEIN TO P.
ABYSII GLYCOGEN
SYNTHASE)		 1g67 THIAMIN PHOSPHATE
SYNTHASE
(Bacillus
subtilis) 		5 / 12 GLN A  57
GLU A  60
ILE A 208
ASN A  36
TYR A  29
 ICP  A2001 (-3.3A)
None
TZP  A2005 (-3.6A)
None
ICP  A2001 (-4.2A)
 1.25A 4s0vA-1g67A:
2.6		 4s0vA-1g67A:
17.69
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.
5T2Z_B_017B201_2
(PROTEASE)		 1g67 THIAMIN PHOSPHATE
SYNTHASE
(Bacillus
subtilis) 		6 / 12 LEU A 170
GLY A 149
VAL A 197
GLY A 187
SER A 169
ILE A 171
 None
ICP  A2001 (-3.6A)
None
TZP  A2005 ( 3.9A)
None
None
 1.45A 5t2zB-1g67A:
undetectable		 5t2zB-1g67A:
19.16
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.
6AG0_A_ACRA608_0
(ALPHA-AMYLASE)		 1g67 THIAMIN PHOSPHATE
SYNTHASE
(Bacillus
subtilis) 		4 / 6 GLY A 128
GLN A  57
TYR A  29
TYR A 147
 None
ICP  A2001 (-3.3A)
ICP  A2001 (-4.2A)
None
 1.08A 6ag0A-1g67A:
8.5		 6ag0A-1g67A:
18.60
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.
6AG0_C_ACRC606_0
(ALPHA-AMYLASE)		 1g67 THIAMIN PHOSPHATE
SYNTHASE
(Bacillus
subtilis) 		4 / 6 GLY A 128
GLN A  57
TYR A  29
TYR A 147
 None
ICP  A2001 (-3.3A)
ICP  A2001 (-4.2A)
None
 1.05A 6ag0C-1g67A:
5.6		 6ag0C-1g67A:
18.60
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.
6MD4_A_BRLA501_0
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 1g67 THIAMIN PHOSPHATE
SYNTHASE
(Bacillus
subtilis) 		5 / 12 GLY A 151
SER A 206
LEU A  26
ILE A 171
HIS A 107
 None
ICP  A2001 ( 4.1A)
None
None
ICP  A2001 ( 3.5A)
 1.42A 6md4A-1g67A:
0.0		 6md4A-1g67A:
16.36