SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'MBT'


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
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3PO7_A_ZONA601_1
(AMINE OXIDASE
[FLAVIN-CONTAINING]
B)
3zyx AMINE OXIDASE
[FLAVIN-CONTAINING]
B

(Homo
sapiens)
7 / 8 TYR A  60
LEU A 171
CYH A 172
GLN A 206
PHE A 343
TYR A 398
TYR A 435
FAD  A 600 (-4.4A)
MBT  A 601 (-4.2A)
None
MBT  A 601 (-3.4A)
MBT  A 601 (-4.7A)
MBT  A 601 ( 3.6A)
MBT  A 601 ( 4.6A)
0.19A 3po7A-3zyxA:
65.2
3po7A-3zyxA:
99.61
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3PO7_B_ZONB601_1
(AMINE OXIDASE
[FLAVIN-CONTAINING]
B)
3zyx AMINE OXIDASE
[FLAVIN-CONTAINING]
B

(Homo
sapiens)
8 / 9 TYR A  60
LEU A 171
CYH A 172
ILE A 198
GLN A 206
PHE A 343
TYR A 398
TYR A 435
FAD  A 600 (-4.4A)
MBT  A 601 (-4.2A)
None
None
MBT  A 601 (-3.4A)
MBT  A 601 (-4.7A)
MBT  A 601 ( 3.6A)
MBT  A 601 ( 4.6A)
0.14A 3po7B-3zyxA:
64.8
3po7B-3zyxA:
99.61
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4A79_A_P1BA601_1
(AMINE OXIDASE
[FLAVIN-CONTAINING]
B)
3zyx AMINE OXIDASE
[FLAVIN-CONTAINING]
B

(Homo
sapiens)
10 / 12 PRO A 104
TRP A 119
LEU A 164
LEU A 171
CYH A 172
GLN A 206
ILE A 316
PHE A 343
TYR A 398
TYR A 435
None
None
None
MBT  A 601 (-4.2A)
None
MBT  A 601 (-3.4A)
MBT  A 601 (-4.6A)
MBT  A 601 (-4.7A)
MBT  A 601 ( 3.6A)
MBT  A 601 ( 4.6A)
0.33A 4a79A-3zyxA:
65.3
4a79A-3zyxA:
99.61
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4A79_B_P1BB601_1
(AMINE OXIDASE
[FLAVIN-CONTAINING]
B)
3zyx AMINE OXIDASE
[FLAVIN-CONTAINING]
B

(Homo
sapiens)
10 / 12 PRO A 104
TRP A 119
LEU A 164
LEU A 171
CYH A 172
GLN A 206
ILE A 316
PHE A 343
TYR A 398
TYR A 435
None
None
None
MBT  A 601 (-4.2A)
None
MBT  A 601 (-3.4A)
MBT  A 601 (-4.6A)
MBT  A 601 (-4.7A)
MBT  A 601 ( 3.6A)
MBT  A 601 ( 4.6A)
0.43A 4a79B-3zyxA:
64.7
4a79B-3zyxA:
99.61
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4A7A_A_RGZA601_1
(AMINE OXIDASE
[FLAVIN-CONTAINING]
B)
3zyx AMINE OXIDASE
[FLAVIN-CONTAINING]
B

(Homo
sapiens)
9 / 11 TYR A  60
LEU A 164
LEU A 171
CYH A 172
GLN A 206
ILE A 316
PHE A 343
TYR A 398
TYR A 435
FAD  A 600 (-4.4A)
None
MBT  A 601 (-4.2A)
None
MBT  A 601 (-3.4A)
MBT  A 601 (-4.6A)
MBT  A 601 (-4.7A)
MBT  A 601 ( 3.6A)
MBT  A 601 ( 4.6A)
0.20A 4a7aA-3zyxA:
65.3
4a7aA-3zyxA:
99.61
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4A7A_B_RGZB601_1
(AMINE OXIDASE
[FLAVIN-CONTAINING]
B)
3zyx AMINE OXIDASE
[FLAVIN-CONTAINING]
B

(Homo
sapiens)
10 / 12 PRO A 104
LEU A 164
LEU A 167
LEU A 171
CYH A 172
GLN A 206
ILE A 316
PHE A 343
TYR A 398
TYR A 435
None
None
None
MBT  A 601 (-4.2A)
None
MBT  A 601 (-3.4A)
MBT  A 601 (-4.6A)
MBT  A 601 (-4.7A)
MBT  A 601 ( 3.6A)
MBT  A 601 ( 4.6A)
0.42A 4a7aB-3zyxA:
64.9
4a7aB-3zyxA:
99.61
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.
4PEV_B_ADNB501_1
(MEMBRANE LIPOPROTEIN
FAMILY PROTEIN)
3zyx AMINE OXIDASE
[FLAVIN-CONTAINING]
B

(Homo
sapiens)
5 / 12 VAL A 294
GLY A  57
PHE A 343
GLY A 342
ASP A 330
None
FAD  A 600 ( 3.8A)
MBT  A 601 (-4.7A)
None
None
1.35A 4pevB-3zyxA:
2.5
4pevB-3zyxA:
21.44