SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1a05'

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.
1HSH_C_MK1C402_2
(HIV-II PROTEASE)		 1a05 3-ISOPROPYLMALATE
DEHYDROGENASE
(Acidithiobacillu
s
ferrooxidans) 		4 / 8 ALA A 290
GLY A 260
ILE A 259
ILE A  16
 None
 0.69A 1hshD-1a05A:
0.0		 1hshD-1a05A:
17.49
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.
2ZUJ_A_CAMA422_0
(CAMPHOR
5-MONOOXYGENASE)		 1a05 3-ISOPROPYLMALATE
DEHYDROGENASE
(Acidithiobacillu
s
ferrooxidans) 		4 / 8 LEU A 303
VAL A 350
LEU A 354
VAL A 320
 None
 0.85A 2zujA-1a05A:
0.0		 2zujA-1a05A:
24.49
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.
3B0W_B_DGXB1_1
(NUCLEAR RECEPTOR
ROR-GAMMA)		 1a05 3-ISOPROPYLMALATE
DEHYDROGENASE
(Acidithiobacillu
s
ferrooxidans) 		5 / 12 GLN A  22
LEU A 354
ALA A  19
VAL A 320
HIS A 278
 None
 1.25A 3b0wB-1a05A:
0.0		 3b0wB-1a05A:
20.17
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.
3IA4_D_MTXD164_2
(DIHYDROFOLATE
REDUCTASE)		 1a05 3-ISOPROPYLMALATE
DEHYDROGENASE
(Acidithiobacillu
s
ferrooxidans) 		3 / 3 ARG A  95
ILE A 170
THR A 197
 IPM  A 401 (-3.2A)
None
None
 0.72A 3ia4D-1a05A:
0.0		 3ia4D-1a05A:
19.31
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.
3M6V_A_SAMA465_0
(RRNA METHYLASE)		 1a05 3-ISOPROPYLMALATE
DEHYDROGENASE
(Acidithiobacillu
s
ferrooxidans) 		5 / 12 ALA A  72
PRO A  87
GLY A  43
GLY A  44
PRO A 276
 None
 1.08A 3m6vA-1a05A:
undetectable		 3m6vA-1a05A:
23.91
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.
3M6W_A_SAMA465_0
(RRNA METHYLASE)		 1a05 3-ISOPROPYLMALATE
DEHYDROGENASE
(Acidithiobacillu
s
ferrooxidans) 		5 / 12 ALA A  72
PRO A  87
GLY A  43
GLY A  44
PRO A 276
 None
 1.07A 3m6wA-1a05A:
undetectable		 3m6wA-1a05A:
23.91
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.
3R9T_A_BEZA264_0
(ECHA1_1)		 1a05 3-ISOPROPYLMALATE
DEHYDROGENASE
(Acidithiobacillu
s
ferrooxidans) 		4 / 8 ILE A 170
LEU A 239
ALA A 177
ALA A 178
 None
 0.72A 3r9tA-1a05A:
undetectable		 3r9tA-1a05A:
21.82
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.
3VW1_D_CVID301_0
(PUTATIVE REGULATORY
PROTEIN)		 1a05 3-ISOPROPYLMALATE
DEHYDROGENASE
(Acidithiobacillu
s
ferrooxidans) 		5 / 12 ILE A  69
SER A 298
ALA A  31
CYH A  37
ASP A  28
 None
 1.20A 3vw1D-1a05A:
0.4		 3vw1D-1a05A:
21.31
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.
4MMC_A_29JA604_1
(TRANSPORTER)		 1a05 3-ISOPROPYLMALATE
DEHYDROGENASE
(Acidithiobacillu
s
ferrooxidans) 		4 / 7 ILE A   4
LEU A  24
ASP A  25
ASP A  28
 None
 0.85A 4mmcA-1a05A:
0.0		 4mmcA-1a05A:
21.56
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.
5KMD_C_6UBC1304_1
(ION TRANSPORT
PROTEIN)		 1a05 3-ISOPROPYLMALATE
DEHYDROGENASE
(Acidithiobacillu
s
ferrooxidans) 		4 / 5 TYR A 140
ILE A 139
LEU A 248
GLY A 245
 IPM  A 401 (-4.5A)
None
None
None
 0.76A 5kmdC-1a05A:
0.2
5kmdD-1a05A:
undetectable		 5kmdC-1a05A:
21.49
5kmdD-1a05A:
21.49
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.
5N0R_A_SAMA501_1
(PEPTIDE
N-METHYLTRANSFERASE)		 1a05 3-ISOPROPYLMALATE
DEHYDROGENASE
(Acidithiobacillu
s
ferrooxidans) 		4 / 4 SER A 249
ALA A 252
GLN A 108
THR A 256
 None
 1.50A 5n0rA-1a05A:
0.6		 5n0rA-1a05A:
24.04
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.
6MDQ_A_TESA604_0
(SERUM ALBUMIN)		 1a05 3-ISOPROPYLMALATE
DEHYDROGENASE
(Acidithiobacillu
s
ferrooxidans) 		4 / 8 ALA A 281
GLY A  13
ALA A 290
LYS A 289
 None
 0.82A 6mdqA-1a05A:
undetectable		 6mdqA-1a05A:
14.20