SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3on9'

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.
2OA1_A_TRPA2003_0
(TRYPTOPHAN
HALOGENASE)		 3on9 TUMOUR NECROSIS
FACTOR RECEPTOR
(Ectromelia
virus) 		5 / 12 ILE A 166
PRO A 206
HIS A 266
PHE A 163
GLU A 268
 None
 1.49A 2oa1B-3on9A:
undetectable		 2oa1B-3on9A:
15.41
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.
2OXT_B_SAMB300_1
(NUCLEOSIDE-2'-O-METH
YLTRANSFERASE)		 3on9 TUMOUR NECROSIS
FACTOR RECEPTOR
(Ectromelia
virus) 		4 / 5 SER A 248
GLY A 249
ASP A 281
ASP A 275
 None
 1.06A 2oxtB-3on9A:
undetectable		 2oxtB-3on9A:
20.08
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.
2Q6F_C_010C6_0
(INFECTIOUS
BRONCHITIS VIRUS
(IBV) MAIN PROTEASE
N-[(5-METHYLISOXAZOL
-3-YL)CARBONYL]ALANY
L-L-VALYL-N~1~-((1R,
2Z)-4-(BENZYLOXY)-4-
OXO-1-{[(3R)-2-OXOPY
RROLIDIN-3-YL]METHYL
}BUT-2-ENYL)-L-LEUCI
NAMIDE)		 3on9 TUMOUR NECROSIS
FACTOR RECEPTOR
(Ectromelia
virus) 		3 / 3 ASN A 241
LEU A 199
HIS A 201
 None
 0.66A 2q6fB-3on9A:
undetectable		 2q6fB-3on9A:
18.39
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.
3CFQ_B_DIFB1_1
(TRANSTHYRETIN)		 3on9 TUMOUR NECROSIS
FACTOR RECEPTOR
(Ectromelia
virus) 		4 / 7 SER A 182
LEU A 242
LEU A 199
SER A 188
 None
 0.96A 3cfqA-3on9A:
undetectable
3cfqB-3on9A:
undetectable		 3cfqA-3on9A:
20.59
3cfqB-3on9A:
20.59
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.
3EIG_A_MTXA200_2
(DIHYDROFOLATE
REDUCTASE)		 3on9 TUMOUR NECROSIS
FACTOR RECEPTOR
(Ectromelia
virus) 		4 / 5 ASP A 167
ILE A 170
VAL A 270
THR A 258
 None
 1.08A 3eigA-3on9A:
undetectable		 3eigA-3on9A:
20.90
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.
3EIG_A_MTXA200_2
(DIHYDROFOLATE
REDUCTASE)		 3on9 TUMOUR NECROSIS
FACTOR RECEPTOR
(Ectromelia
virus) 		4 / 5 ASP A 167
ILE A 170
VAL A 270
THR A 259
 None
 1.14A 3eigA-3on9A:
undetectable		 3eigA-3on9A:
20.90
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.
3IX9_A_MTXA200_1
(DIHYDROFOLATE
REDUCTASE)		 3on9 TUMOUR NECROSIS
FACTOR RECEPTOR
(Ectromelia
virus) 		5 / 12 ILE A 284
ALA A 300
LEU A 255
GLN A 254
VAL A 168
 None
 1.08A 3ix9A-3on9A:
undetectable		 3ix9A-3on9A:
21.99
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.
4IKL_A_SUZA201_1
(TRANSTHYRETIN)		 3on9 TUMOUR NECROSIS
FACTOR RECEPTOR
(Ectromelia
virus) 		4 / 7 LEU A 242
LEU A 199
SER A 188
SER A 182
 None
 1.06A 4iklA-3on9A:
undetectable
4iklB-3on9A:
undetectable		 4iklA-3on9A:
22.16
4iklB-3on9A:
22.16
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.
4L4C_B_CAMB502_0
(CAMPHOR
5-MONOOXYGENASE)		 3on9 TUMOUR NECROSIS
FACTOR RECEPTOR
(Ectromelia
virus) 		4 / 8 THR A 303
LEU A 255
VAL A 270
ILE A 170
 None
 1.01A 4l4cB-3on9A:
undetectable		 4l4cB-3on9A:
16.23
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.
6MN4_D_AM2D301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 3on9 TUMOUR NECROSIS
FACTOR RECEPTOR
(Ectromelia
virus) 		4 / 8 ASP A 297
HIS A 266
ASP A 167
GLU A 169
 None
 1.15A 6mn4D-3on9A:
undetectable		 6mn4D-3on9A:
19.77