SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3u80'

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.
1ERR_A_CCSA381_0
(ESTROGEN RECEPTOR)		 3u80 3-DEHYDROQUINATE
DEHYDRATASE, TYPE II
(Bifidobacterium
longum) 		4 / 5 HIS A  80
GLU A  54
ALA A  86
SER A 120
 None
 1.17A 1errA-3u80A:
undetectable
1errB-3u80A:
undetectable		 1errA-3u80A:
20.72
1errB-3u80A:
20.72
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.
2EJG_B_ADNB1502_1
(235AA LONG
HYPOTHETICAL
BIOTIN--[ACETYL-COA-
CARBOXYLASE] LIGASE)		 3u80 3-DEHYDROQUINATE
DEHYDRATASE, TYPE II
(Bifidobacterium
longum) 		4 / 7 GLU A 101
ASN A   8
PRO A  75
ALA A  76
 None
 1.45A 2ejgB-3u80A:
undetectable		 2ejgB-3u80A:
20.09
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.
2H77_A_T3A1_1
(THRA PROTEIN)		 3u80 3-DEHYDROQUINATE
DEHYDRATASE, TYPE II
(Bifidobacterium
longum) 		5 / 12 ILE A   5
ALA A  64
MET A  57
ALA A  89
LEU A  99
 None
 1.04A 2h77A-3u80A:
undetectable		 2h77A-3u80A:
17.34
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.
4LNW_A_T3A501_1
(THYROID HORMONE
RECEPTOR ALPHA)		 3u80 3-DEHYDROQUINATE
DEHYDRATASE, TYPE II
(Bifidobacterium
longum) 		5 / 12 ILE A   5
ALA A  64
MET A  57
ALA A  89
LEU A  99
 None
 1.10A 4lnwA-3u80A:
undetectable		 4lnwA-3u80A:
17.47
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.
4LNX_A_T3A502_1
(THYROID HORMONE
RECEPTOR ALPHA)		 3u80 3-DEHYDROQUINATE
DEHYDRATASE, TYPE II
(Bifidobacterium
longum) 		5 / 12 ILE A   5
ALA A  64
MET A  57
ALA A  89
LEU A  99
 None
 1.09A 4lnxA-3u80A:
undetectable		 4lnxA-3u80A:
17.47
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.
4P6X_I_HCYI900_2
(GLUCOCORTICOID
RECEPTOR)		 3u80 3-DEHYDROQUINATE
DEHYDRATASE, TYPE II
(Bifidobacterium
longum) 		3 / 3 MET A  57
MET A  91
TYR A  81
 None
 1.39A 4p6xI-3u80A:
undetectable		 4p6xI-3u80A:
20.85
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.
4YBN_A_ACTA303_0
(FLAVIN-NUCLEOTIDE-BI
NDING PROTEIN)		 3u80 3-DEHYDROQUINATE
DEHYDRATASE, TYPE II
(Bifidobacterium
longum) 		3 / 3 VAL A  72
TYR A 135
ALA A 138
 None
 0.34A 4ybnA-3u80A:
undetectable		 4ybnA-3u80A:
24.32
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.
5NWV_A_ACAA18_2
(SCRFP-TAG,GP41)		 3u80 3-DEHYDROQUINATE
DEHYDRATASE, TYPE II
(Bifidobacterium
longum) 		4 / 7 LEU A 137
ASP A 140
ALA A 143
LEU A 146
 None
 1.05A 5nwvA-3u80A:
undetectable		 5nwvA-3u80A:
10.00
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.
5X23_A_LSNA503_1
(CYTOCHROME P450 2C9)		 3u80 3-DEHYDROQUINATE
DEHYDRATASE, TYPE II
(Bifidobacterium
longum) 		4 / 5 PRO A  10
GLY A   9
THR A  51
ASN A   8
 None
 1.07A 5x23A-3u80A:
undetectable		 5x23A-3u80A:
16.55
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.
6AF6_A_GLYA507_0
(L-PROLYL-[PEPTIDYL-C
ARRIER PROTEIN]
DEHYDROGENASE)		 3u80 3-DEHYDROQUINATE
DEHYDRATASE, TYPE II
(Bifidobacterium
longum) 		3 / 3 TYR A  83
HIS A  90
MET A  91
 None
 1.25A 6af6A-3u80A:
undetectable		 6af6A-3u80A:
17.30