SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3t8u'

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.
1E3V_A_DXCA801_0
(STEROID
DELTA-ISOMERASE)		 3t8u STEROID
DELTA-ISOMERASE
(Comamonas
testosteroni) 		6 / 12 ASP A  38
PHE A  54
PHE A  82
VAL A  65
MET A 112
ALA A 114
 None
 1.45A 1e3vA-3t8uA:
21.5		 1e3vA-3t8uA:
34.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1E3V_A_DXCA801_0
(STEROID
DELTA-ISOMERASE)		 3t8u STEROID
DELTA-ISOMERASE
(Comamonas
testosteroni) 		6 / 12 ASP A  38
PHE A  54
PHE A  82
VAL A  84
MET A 112
ALA A 114
 None
 0.77A 1e3vA-3t8uA:
21.5		 1e3vA-3t8uA:
34.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1E3V_A_DXCA801_0
(STEROID
DELTA-ISOMERASE)		 3t8u STEROID
DELTA-ISOMERASE
(Comamonas
testosteroni) 		5 / 12 ASP A  38
PHE A  54
VAL A  95
MET A 112
ALA A 114
 None
 1.24A 1e3vA-3t8uA:
21.5		 1e3vA-3t8uA:
34.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1E3V_B_DXCB801_0
(STEROID
DELTA-ISOMERASE)		 3t8u STEROID
DELTA-ISOMERASE
(Comamonas
testosteroni) 		5 / 11 ASP A  38
PHE A  54
PHE A  82
MET A 112
ALA A 114
 None
 0.78A 1e3vB-3t8uA:
21.3		 1e3vB-3t8uA:
34.85
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.
2EJ3_A_GBNA2414_1
(BRANCHED-CHAIN AMINO
ACID
AMINOTRANSFERASE)		 3t8u STEROID
DELTA-ISOMERASE
(Comamonas
testosteroni) 		4 / 8 GLY A  47
THR A  48
ALA A  49
ALA A  50
 None
 0.55A 2ej3A-3t8uA:
undetectable		 2ej3A-3t8uA:
18.83
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3NBR_A_ASDA129_1
(STEROID
DELTA-ISOMERASE)		 3t8u STEROID
DELTA-ISOMERASE
(Comamonas
testosteroni) 		5 / 12 PHE A  54
SER A  58
PHE A  82
VAL A  65
MET A 112
 None
 1.49A 3nbrA-3t8uA:
23.9		 3nbrA-3t8uA:
96.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3NBR_A_ASDA129_1
(STEROID
DELTA-ISOMERASE)		 3t8u STEROID
DELTA-ISOMERASE
(Comamonas
testosteroni) 		9 / 12 PHE A  54
SER A  58
PHE A  82
VAL A  84
PHE A  86
VAL A  95
PRO A  97
MET A 112
PHE A 116
 None
 0.57A 3nbrA-3t8uA:
23.9		 3nbrA-3t8uA:
96.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3NHX_A_ASDA126_1
(STEROID
DELTA-ISOMERASE)		 3t8u STEROID
DELTA-ISOMERASE
(Comamonas
testosteroni) 		10 / 12 LEU A  18
ASP A  38
PHE A  54
SER A  58
PHE A  82
PHE A  86
VAL A  95
MET A 112
ALA A 114
PHE A 116
 None
 0.48A 3nhxA-3t8uA:
24.6		 3nhxA-3t8uA:
97.60
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3NUV_A_ASDA126_1
(STEROID
DELTA-ISOMERASE)		 3t8u STEROID
DELTA-ISOMERASE
(Comamonas
testosteroni) 		9 / 12 PHE A  54
SER A  58
LEU A  63
PHE A  82
PHE A  86
VAL A  95
MET A 112
ALA A 114
PHE A 116
 None
 0.74A 3nuvA-3t8uA:
24.3		 3nuvA-3t8uA:
96.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3NUV_B_ASDB126_1
(STEROID
DELTA-ISOMERASE)		 3t8u STEROID
DELTA-ISOMERASE
(Comamonas
testosteroni) 		7 / 10 SER A  58
LEU A  63
PHE A  82
VAL A  84
PRO A  97
MET A 112
ALA A 114
 None
 0.62A 3nuvB-3t8uA:
24.5		 3nuvB-3t8uA:
96.80
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.
3R6W_A_NFZA213_1
(FMN-DEPENDENT
NADH-AZOREDUCTASE 1)		 3t8u STEROID
DELTA-ISOMERASE
(Comamonas
testosteroni) 		5 / 10 PHE A  82
PHE A  30
VAL A  11
PHE A 101
PHE A  80
 None
 1.48A 3r6wA-3t8uA:
undetectable
3r6wB-3t8uA:
undetectable		 3r6wA-3t8uA:
19.44
3r6wB-3t8uA:
19.44