SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2bun'

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.
5KKZ_A_ASCA1004_0
(CYTOCHROME B
UBIQUINOL-CYTOCHROME
C REDUCTASE
IRON-SULFUR SUBUNIT)		 2bun APPA
(Rhodobacter
sphaeroides) 		4 / 6 HIS A  68
VAL A  72
GLN A  49
HIS A  44
 None
None
None
FAD  A1126 (-3.3A)
 1.24A 5kkzA-2bunA:
undetectable
5kkzG-2bunA:
undetectable		 5kkzA-2bunA:
15.44
5kkzG-2bunA:
17.65
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.
5KKZ_E_ASCE1004_0
(CYTOCHROME B
UBIQUINOL-CYTOCHROME
C REDUCTASE
IRON-SULFUR SUBUNIT)		 2bun APPA
(Rhodobacter
sphaeroides) 		4 / 7 HIS A  44
HIS A  68
VAL A  72
GLN A  49
 FAD  A1126 (-3.3A)
None
None
None
 1.29A 5kkzC-2bunA:
undetectable
5kkzE-2bunA:
undetectable		 5kkzC-2bunA:
17.65
5kkzE-2bunA:
15.44
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.
5KKZ_K_ASCK1004_0
(CYTOCHROME B
UBIQUINOL-CYTOCHROME
C REDUCTASE
IRON-SULFUR SUBUNIT)		 2bun APPA
(Rhodobacter
sphaeroides) 		4 / 7 HIS A  68
VAL A  72
GLN A  49
HIS A  44
 None
None
None
FAD  A1126 (-3.3A)
 1.24A 5kkzK-2bunA:
undetectable
5kkzQ-2bunA:
undetectable		 5kkzK-2bunA:
15.44
5kkzQ-2bunA:
17.65
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.
5KKZ_O_ASCO1004_0
(CYTOCHROME B
UBIQUINOL-CYTOCHROME
C REDUCTASE
IRON-SULFUR SUBUNIT)		 2bun APPA
(Rhodobacter
sphaeroides) 		4 / 7 HIS A  44
HIS A  68
VAL A  72
GLN A  49
 FAD  A1126 (-3.3A)
None
None
None
 1.29A 5kkzM-2bunA:
undetectable
5kkzO-2bunA:
undetectable		 5kkzM-2bunA:
17.65
5kkzO-2bunA:
15.44
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.
5XDH_A_DAHA60_1
(PUTATIVE CYTOCHROME
C)		 2bun APPA
(Rhodobacter
sphaeroides) 		4 / 6 ASN A  45
VAL A  38
LEU A  34
GLN A  42
 FAD  A1126 (-2.3A)
None
None
None
 1.50A 5xdhA-2bunA:
undetectable
5xdhC-2bunA:
undetectable		 5xdhA-2bunA:
16.53
5xdhC-2bunA:
16.53