SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'K95'


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.
1DSC_C_DVAC8_0
(ACTINOMYCIN D)		 5yid PLASMEPSIN II
(Plasmodium
falciparum) 		3 / 3 THR A 116
THR A 118
PRO A 115
 K95  A 401 ( 4.9A)
None
CPS  A 402 ( 4.9A)
 0.84A 1dscC-5yidA:
undetectable		 1dscC-5yidA:
undetectable
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2V0Z_C_C41C1328_1
(RENIN)		 5yid PLASMEPSIN II
(Plasmodium
falciparum) 		7 / 12 ASP A  36
GLY A  38
SER A  39
TYR A  79
ASP A 216
GLY A 218
SER A 220
 K95  A 401 ( 2.6A)
K95  A 401 ( 3.5A)
K95  A 401 ( 4.8A)
K95  A 401 (-4.3A)
NA  A 403 ( 1.9A)
K95  A 401 ( 3.6A)
K95  A 401 (-3.3A)
 0.72A 2v0zC-5yidA:
40.1		 2v0zC-5yidA:
36.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2V0Z_C_C41C1328_1
(RENIN)		 5yid PLASMEPSIN II
(Plasmodium
falciparum) 		5 / 12 ASP A  36
GLY A  38
SER A  39
TYR A  79
PHE A 122
 K95  A 401 ( 2.6A)
K95  A 401 ( 3.5A)
K95  A 401 ( 4.8A)
K95  A 401 (-4.3A)
None
 0.77A 2v0zC-5yidA:
40.1		 2v0zC-5yidA:
36.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2V0Z_O_C41O1327_1
(RENIN)		 5yid PLASMEPSIN II
(Plasmodium
falciparum) 		5 / 12 ASP A  36
GLY A  38
ASP A 216
GLY A 218
SER A 220
 K95  A 401 ( 2.6A)
K95  A 401 ( 3.5A)
NA  A 403 ( 1.9A)
K95  A 401 ( 3.6A)
K95  A 401 (-3.3A)
 0.69A 2v0zO-5yidA:
39.4		 2v0zO-5yidA:
36.00
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.
3M0W_E_P77E203_1
(PROTEIN S100-A4)		 5yid PLASMEPSIN II
(Plasmodium
falciparum) 		4 / 8 ASP A 305
PHE A 315
LEU A 126
ASP A  36
 None
None
None
K95  A 401 ( 2.6A)
 1.06A 3m0wE-5yidA:
undetectable
3m0wF-5yidA:
undetectable
3m0wG-5yidA:
undetectable
3m0wH-5yidA:
undetectable		 3m0wE-5yidA:
15.89
3m0wF-5yidA:
15.89
3m0wG-5yidA:
15.89
3m0wH-5yidA:
15.89
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.
3MDR_B_GJZB506_1
(CHOLESTEROL
24-HYDROXYLASE)		 5yid PLASMEPSIN II
(Plasmodium
falciparum) 		4 / 6 PHE A 296
ILE A 214
ALA A 221
THR A 219
 K95  A 401 (-4.0A)
None
K95  A 401 ( 4.0A)
K95  A 401 (-3.8A)
 1.06A 3mdrB-5yidA:
undetectable		 3mdrB-5yidA:
12.28
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.
3PRS_A_RITA1001_2
(ENDOTHIAPEPSIN)		 5yid PLASMEPSIN II
(Plasmodium
falciparum) 		5 / 12 ASP A  36
GLY A  38
ASP A 216
THR A 219
ILE A 302
 K95  A 401 ( 2.6A)
K95  A 401 ( 3.5A)
NA  A 403 ( 1.9A)
K95  A 401 (-3.8A)
None
 0.38A 3prsA-5yidA:
36.1		 3prsA-5yidA:
14.18
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.
3PWW_A_ROCA1001_1
(ENDOTHIAPEPSIN)		 5yid PLASMEPSIN II
(Plasmodium
falciparum) 		5 / 12 ASP A  36
PHE A 113
ILE A 214
THR A 219
ILE A 302
 K95  A 401 ( 2.6A)
None
None
K95  A 401 (-3.8A)
None
 0.64A 3pwwA-5yidA:
36.1		 3pwwA-5yidA:
14.18
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.
3Q70_A_RITA2001_1
(CANDIDAPEPSIN-2)		 5yid PLASMEPSIN II
(Plasmodium
falciparum) 		6 / 12 ILE A  34
ASP A  36
GLY A  38
ASP A 216
THR A 219
ILE A 302
 K95  A 401 ( 4.0A)
K95  A 401 ( 2.6A)
K95  A 401 ( 3.5A)
NA  A 403 ( 1.9A)
K95  A 401 (-3.8A)
None
 0.34A 3q70A-5yidA:
9.7		 3q70A-5yidA:
15.35
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.
3TNE_A_RITA401_1
(SECRETED ASPARTIC
PROTEASE)		 5yid PLASMEPSIN II
(Plasmodium
falciparum) 		5 / 12 ILE A  34
ASP A  36
GLY A  38
ASP A 216
ILE A 302
 K95  A 401 ( 4.0A)
K95  A 401 ( 2.6A)
K95  A 401 ( 3.5A)
NA  A 403 ( 1.9A)
None
 0.45A 3tneA-5yidA:
34.4		 3tneA-5yidA:
12.09
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.
3TNE_A_RITA401_1
(SECRETED ASPARTIC
PROTEASE)		 5yid PLASMEPSIN II
(Plasmodium
falciparum) 		6 / 12 ILE A  34
ASP A  36
GLY A  38
GLY A 304
ASP A 305
SER A 220
 K95  A 401 ( 4.0A)
K95  A 401 ( 2.6A)
K95  A 401 ( 3.5A)
None
None
K95  A 401 (-3.3A)
 1.19A 3tneA-5yidA:
34.4		 3tneA-5yidA:
12.09
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.
3TNE_A_RITA401_1
(SECRETED ASPARTIC
PROTEASE)		 5yid PLASMEPSIN II
(Plasmodium
falciparum) 		5 / 12 ILE A  34
ASP A  36
GLY A  38
SER A  81
ASP A 216
 K95  A 401 ( 4.0A)
K95  A 401 ( 2.6A)
K95  A 401 ( 3.5A)
K95  A 401 ( 2.4A)
NA  A 403 ( 1.9A)
 0.59A 3tneA-5yidA:
34.4		 3tneA-5yidA:
12.09
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.
3TNE_B_RITB401_1
(SECRETED ASPARTIC
PROTEASE)		 5yid PLASMEPSIN II
(Plasmodium
falciparum) 		6 / 12 ILE A  34
ASP A  36
GLY A  38
SER A  81
ASP A 216
ILE A 302
 K95  A 401 ( 4.0A)
K95  A 401 ( 2.6A)
K95  A 401 ( 3.5A)
K95  A 401 ( 2.4A)
NA  A 403 ( 1.9A)
None
 0.69A 3tneB-5yidA:
34.4		 3tneB-5yidA:
12.09
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.
3TNE_B_RITB401_2
(SECRETED ASPARTIC
PROTEASE)		 5yid PLASMEPSIN II
(Plasmodium
falciparum) 		4 / 7 SER A  39
TYR A  79
ILE A 125
THR A 219
 K95  A 401 ( 4.8A)
K95  A 401 (-4.3A)
K95  A 401 ( 4.7A)
K95  A 401 (-3.8A)
 0.55A 3tneB-5yidA:
34.4		 3tneB-5yidA:
12.09
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.
4UBS_A_DIFA502_1
(PENTALENIC ACID
SYNTHASE)		 5yid PLASMEPSIN II
(Plasmodium
falciparum) 		5 / 9 VAL A  44
LEU A  35
SER A  39
LEU A 128
ILE A 141
 None
None
K95  A 401 ( 4.8A)
None
None
 1.21A 4ubsA-5yidA:
undetectable		 4ubsA-5yidA:
9.41
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.
5NZ0_A_ZLDA301_0
(HTH-TYPE
TRANSCRIPTIONAL
REGULATOR ETHR)		 5yid PLASMEPSIN II
(Plasmodium
falciparum) 		5 / 12 GLY A 127
ILE A 125
PHE A  33
TYR A 102
VAL A 138
 None
K95  A 401 ( 4.7A)
None
None
None
 1.31A 5nz0A-5yidA:
undetectable		 5nz0A-5yidA:
undetectable