SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5mln'

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.
1NBI_C_SAMC2293_0
(GLYCINE
N-METHYLTRANSFERASE)		 5mln ALCOHOL
DEHYDROGENASE 3
([Candida]
magnoliae) 		5 / 12 TYR A 157
GLY A 147
ALA A 159
SER A 160
TYR A 189
 NAP  A 301 (-4.7A)
None
None
None
None
 1.30A 1nbiC-5mlnA:
6.7		 1nbiC-5mlnA:
undetectable
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)		 5mln ALCOHOL
DEHYDROGENASE 3
([Candida]
magnoliae) 		4 / 7 THR A 192
GLU A 211
THR A 190
VAL A 219
 NAP  A 301 (-2.7A)
None
NAP  A 301 (-4.3A)
None
 1.17A 1tv8B-5mlnA:
2.2		 1tv8B-5mlnA:
undetectable
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.
2BM9_B_SAMB301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 5mln ALCOHOL
DEHYDROGENASE 3
([Candida]
magnoliae) 		5 / 12 GLY A  11
SER A  20
ARG A  36
ASP A  63
ASN A  89
 NAP  A 301 (-3.2A)
None
NAP  A 301 (-3.5A)
NAP  A 301 (-4.0A)
NAP  A 301 (-3.2A)
 1.32A 2bm9B-5mlnA:
5.0		 2bm9B-5mlnA:
undetectable
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)		 5mln ALCOHOL
DEHYDROGENASE 3
([Candida]
magnoliae) 		4 / 7 THR A 192
GLU A 211
THR A 190
VAL A 219
 NAP  A 301 (-2.7A)
None
NAP  A 301 (-4.3A)
None
 1.21A 2fb2B-5mlnA:
undetectable		 2fb2B-5mlnA:
undetectable
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.
2NPN_A_SAMA4633_0
(PUTATIVE COBALAMIN
SYNTHESIS RELATED
PROTEIN)		 5mln ALCOHOL
DEHYDROGENASE 3
([Candida]
magnoliae) 		5 / 9 GLY A  75
LEU A  62
LEU A  41
LEU A  78
THR A  32
 None
 1.30A 2npnA-5mlnA:
undetectable		 2npnA-5mlnA:
undetectable
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.
2ZW9_B_SAMB801_1
(LEUCINE CARBOXYL
METHYLTRANSFERASE 2)		 5mln ALCOHOL
DEHYDROGENASE 3
([Candida]
magnoliae) 		4 / 8 ILE A 142
ASN A 113
SER A 160
SER A 144
 NAP  A 301 (-4.6A)
None
None
NAP  A 301 (-3.5A)
 1.13A 2zw9B-5mlnA:
5.2		 2zw9B-5mlnA:
undetectable
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.
3BPX_A_SALA257_1
(TRANSCRIPTIONAL
REGULATOR)		 5mln ALCOHOL
DEHYDROGENASE 3
([Candida]
magnoliae) 		4 / 8 SER A 144
ALA A  93
THR A 195
ILE A 198
 NAP  A 301 (-3.5A)
None
NAP  A 301 (-3.8A)
None
 0.98A 3bpxA-5mlnA:
undetectable
3bpxB-5mlnA:
undetectable		 3bpxA-5mlnA:
22.79
3bpxB-5mlnA:
22.79
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.
3T3S_A_9PLA1_1
(CYTOCHROME P450 2A13)		 5mln ALCOHOL
DEHYDROGENASE 3
([Candida]
magnoliae) 		5 / 9 PHE A  73
ALA A  69
PHE A  86
ALA A 119
LEU A  62
 None
 1.16A 3t3sA-5mlnA:
undetectable		 3t3sA-5mlnA:
11.02
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.
3UBO_B_ADNB353_2
(ADENOSINE KINASE)		 5mln ALCOHOL
DEHYDROGENASE 3
([Candida]
magnoliae) 		4 / 5 SER A 144
ILE A  16
TYR A 157
GLY A 188
 NAP  A 301 (-3.5A)
NAP  A 301 (-3.9A)
NAP  A 301 (-4.7A)
NAP  A 301 (-4.8A)
 1.05A 3uboB-5mlnA:
6.8		 3uboB-5mlnA:
12.91
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.
3VAS_B_ADNB401_2
(PUTATIVE ADENOSINE
KINASE)		 5mln ALCOHOL
DEHYDROGENASE 3
([Candida]
magnoliae) 		4 / 5 LEU A  78
ALA A  80
THR A  32
PHE A  73
 None
 1.35A 3vasB-5mlnA:
6.6		 3vasB-5mlnA:
13.99
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.
4OBW_A_SAMA602_0
(2-METHOXY-6-POLYPREN
YL-1,4-BENZOQUINOL
METHYLASE,
MITOCHONDRIAL)		 5mln ALCOHOL
DEHYDROGENASE 3
([Candida]
magnoliae) 		5 / 12 TYR A 141
ALA A 172
GLY A 230
ILE A 180
GLY A 176
 None
 1.25A 4obwA-5mlnA:
6.4		 4obwA-5mlnA:
undetectable
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.
4OBW_D_SAMD601_0
(2-METHOXY-6-POLYPREN
YL-1,4-BENZOQUINOL
METHYLASE,
MITOCHONDRIAL)		 5mln ALCOHOL
DEHYDROGENASE 3
([Candida]
magnoliae) 		5 / 12 TYR A 141
ALA A 172
GLY A 230
ILE A 180
GLY A 176
 None
 1.29A 4obwD-5mlnA:
6.0		 4obwD-5mlnA:
undetectable
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.
5H3A_B_D16B401_1
(ORF70)		 5mln ALCOHOL
DEHYDROGENASE 3
([Candida]
magnoliae) 		4 / 7 ILE A 118
ASP A 165
LEU A 164
GLY A 163
 None
 0.82A 5h3aB-5mlnA:
undetectable		 5h3aB-5mlnA:
16.67
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.
5X5Q_D_D16D402_1
(THYMIDYLATE SYNTHASE)		 5mln ALCOHOL
DEHYDROGENASE 3
([Candida]
magnoliae) 		4 / 8 ILE A 118
ASP A 165
LEU A 164
GLY A 163
 None
 0.76A 5x5qD-5mlnA:
undetectable		 5x5qD-5mlnA:
14.19
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.
5X5Q_F_D16F402_1
(THYMIDYLATE SYNTHASE)		 5mln ALCOHOL
DEHYDROGENASE 3
([Candida]
magnoliae) 		4 / 8 ILE A 118
ASP A 165
LEU A 164
GLY A 163
 None
 0.76A 5x5qF-5mlnA:
undetectable		 5x5qF-5mlnA:
14.19
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.
6BTX_A_EDTA503_0
(SOLUTE CARRIER
FAMILY 39
(IRON-REGULATED
TRANSPORTER))		 5mln ALCOHOL
DEHYDROGENASE 3
([Candida]
magnoliae) 		4 / 7 SER A  37
SER A  13
GLY A  12
ARG A  14
 NAP  A 301 (-2.8A)
NAP  A 301 (-2.7A)
NAP  A 301 ( 4.7A)
NAP  A 301 (-3.0A)
 1.00A 6btxA-5mlnA:
undetectable		 6btxA-5mlnA:
undetectable