SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1e50'

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.
1JLB_A_NVPA999_1
(HIV-1 RT A-CHAIN)		 1e50 CORE-BINDING FACTOR
CBF-BETA
(Homo
sapiens) 		4 / 8 LEU B 125
CYH B  25
GLY B 112
LEU B  64
 None
 0.86A 1jlbA-1e50B:
undetectable		 1jlbA-1e50B:
14.79
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.
1WRL_F_TFPF211_1
(TROPONIN C, SLOW
SKELETAL AND CARDIAC
MUSCLES)		 1e50 CORE-BINDING FACTOR
CBF-BETA
(Homo
sapiens) 		4 / 7 LEU B 103
PHE B  12
PHE B  17
LEU B  64
 None
 1.04A 1wrlE-1e50B:
undetectable
1wrlF-1e50B:
undetectable		 1wrlE-1e50B:
22.30
1wrlF-1e50B:
22.30
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.
2QMM_B_SAMB301_0
(UPF0217 PROTEIN
AF_1056)		 1e50 CORE-BINDING FACTOR
CBF-BETA
(Homo
sapiens) 		5 / 11 LEU B  64
GLY B  61
SER B  65
LEU B  66
SER B  53
 None
 1.01A 2qmmA-1e50B:
undetectable
2qmmB-1e50B:
undetectable		 2qmmA-1e50B:
17.41
2qmmB-1e50B:
17.41
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.
3CR5_X_PNTX94_0
(PROTEIN S100-B)		 1e50 CORE-BINDING FACTOR
CBF-BETA
(Homo
sapiens) 		3 / 3 PHE B  44
CYH B  48
PHE B  68
 None
 0.70A 3cr5X-1e50B:
undetectable		 3cr5X-1e50B:
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.
3JW5_A_TOPA208_1
(DIHYDROFOLATE
REDUCTASE)		 1e50 CORE-BINDING FACTOR
CBF-BETA
(Homo
sapiens) 		5 / 11 ALA B  99
ASN B  63
LEU B  64
LEU B 125
VAL B 108
 None
 1.28A 3jw5A-1e50B:
undetectable		 3jw5A-1e50B:
20.69
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.
5MVS_B_ADNB401_1
(HISTONE-LYSINE
N-METHYLTRANSFERASE,
H3 LYSINE-79
SPECIFIC)		 1e50 CORE-BINDING FACTOR
CBF-BETA
(Homo
sapiens) 		4 / 8 GLY B 105
ALA B 132
ASP B   7
PHE B  18
 None
 0.94A 5mvsB-1e50B:
undetectable		 5mvsB-1e50B:
17.59