SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3wic'

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.
1FK9_A_EFZA999_1
(HIV-1 RT, A-CHAIN)		 3wic GLUCOSE
1-DEHYDROGENASE
(Thermoplasma
volcanium) 		5 / 10 LEU A 248
VAL A 204
VAL A 212
TYR A 201
GLY A 205
 None
 1.46A 1fk9A-3wicA:
undetectable		 1fk9A-3wicA:
22.73
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.
1IKV_A_EFZA2000_1
(POL POLYPROTEIN)		 3wic GLUCOSE
1-DEHYDROGENASE
(Thermoplasma
volcanium) 		5 / 9 LEU A 248
VAL A 204
VAL A 212
TYR A 201
GLY A 205
 None
 1.43A 1ikvA-3wicA:
2.2		 1ikvA-3wicA:
22.38
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.
1IKW_A_EFZA2000_1
(POL POLYPROTEIN)		 3wic GLUCOSE
1-DEHYDROGENASE
(Thermoplasma
volcanium) 		5 / 10 LEU A 248
VAL A 204
VAL A 212
TYR A 201
GLY A 205
 None
 1.41A 1ikwA-3wicA:
2.1		 1ikwA-3wicA:
22.38
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.
2I30_A_SALA1200_1
(SERUM ALBUMIN)		 3wic GLUCOSE
1-DEHYDROGENASE
(Thermoplasma
volcanium) 		4 / 4 LEU A 158
ILE A 330
ILE A 151
ALA A 152
 None
 0.89A 2i30A-3wicA:
undetectable		 2i30A-3wicA:
20.26
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.
3VYW_A_SAMA501_1
(MNMC2)		 3wic GLUCOSE
1-DEHYDROGENASE
(Thermoplasma
volcanium) 		4 / 6 HIS A  68
GLU A 353
ASP A  44
GLU A 342
 ZN  A1001 (-3.3A)
None
None
None
 1.26A 3vywA-3wicA:
2.3		 3vywA-3wicA:
22.45
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.
4CUT_A_TYLA2971_1
(BROMODOMAIN ADJACENT
TO ZINC FINGER
DOMAIN PROTEIN 2B)		 3wic GLUCOSE
1-DEHYDROGENASE
(Thermoplasma
volcanium) 		4 / 4 VAL A  89
VAL A  74
ASN A  80
ILE A 137
 None
None
None
1PE  A1005 (-4.7A)
 1.13A 4cutA-3wicA:
undetectable		 4cutA-3wicA:
15.19
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.
4FGZ_B_CQAB302_0
(PHOSPHOETHANOLAMINE
N-METHYLTRANSFERASE)		 3wic GLUCOSE
1-DEHYDROGENASE
(Thermoplasma
volcanium) 		4 / 8 SER A 304
GLU A 166
GLY A 105
ARG A 106
 None
1PE  A1004 ( 3.8A)
None
1PE  A1004 (-4.1A)
 0.94A 4fgzA-3wicA:
6.2
4fgzB-3wicA:
6.3		 4fgzA-3wicA:
22.49
4fgzB-3wicA:
22.49
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_A_HCYA900_1
(GLUCOCORTICOID
RECEPTOR)		 3wic GLUCOSE
1-DEHYDROGENASE
(Thermoplasma
volcanium) 		5 / 12 LEU A 200
MET A 214
THR A 329
ILE A 330
PHE A 231
 None
 1.47A 4p6xA-3wicA:
undetectable		 4p6xA-3wicA:
22.66
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.
4R1Z_B_AERB601_1
(CYP17A1 PROTEIN)		 3wic GLUCOSE
1-DEHYDROGENASE
(Thermoplasma
volcanium) 		4 / 7 ALA A  70
GLY A 121
ALA A 120
GLU A 119
 None
None
PGO  A1003 ( 3.8A)
None
 0.87A 4r1zB-3wicA:
undetectable		 4r1zB-3wicA:
21.82
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.
4XR4_B_AG2B511_1
(HOMOSPERMIDINE
SYNTHASE)		 3wic GLUCOSE
1-DEHYDROGENASE
(Thermoplasma
volcanium) 		3 / 3 VAL A 250
PHE A 168
ARG A 208
 None
 0.85A 4xr4B-3wicA:
5.8		 4xr4B-3wicA:
20.65
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.
5INZ_D_DVAD15_0
(THETA DEFENSIN-2,
D-PEPTIDE
THETA DEFENSIN-2,
L-PEPTIDE)		 3wic GLUCOSE
1-DEHYDROGENASE
(Thermoplasma
volcanium) 		3 / 3 GLY A  97
CYH A 102
CYH A  99
 ZN  A1002 ( 4.9A)
ZN  A1002 (-2.2A)
ZN  A1002 (-2.5A)
 0.88A 5inzB-3wicA:
undetectable		 5inzB-3wicA:
4.82
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.
5UUN_A_ACTA303_0
(GLUTATHIONE
S-TRANSFERASE-LIKE
PROTEIN)		 3wic GLUCOSE
1-DEHYDROGENASE
(Thermoplasma
volcanium) 		3 / 3 GLU A 289
TYR A 293
ARG A 297
 None
 0.81A 5uunA-3wicA:
undetectable		 5uunA-3wicA:
21.05
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.
6BEO_A_DHIA4_0
((DPR)PY(DHI)PKDL(DGN
))		 3wic GLUCOSE
1-DEHYDROGENASE
(Thermoplasma
volcanium) 		3 / 3 TYR A  56
PRO A  58
LEU A  64
 None
 0.84A 6beoA-3wicA:
undetectable		 6beoA-3wicA:
2.23
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.
6GNG_B_QPSB601_3
(-)		 3wic GLUCOSE
1-DEHYDROGENASE
(Thermoplasma
volcanium) 		3 / 3 ASP A 241
ASP A 211
ASN A 179
 None
 0.81A 6gngB-3wicA:
4.0		 6gngB-3wicA:
21.07