SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3mcq'

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.
1CD2_A_FOLA307_1
(DIHYDROFOLATE
REDUCTASE)		 3mcq THIAMINE-MONOPHOSPHA
TE KINASE
(Methylobacillus
flagellatus) 		3 / 3 GLU A 246
ILE A 249
ARG A 170
 None
 0.74A 1cd2A-3mcqA:
undetectable		 1cd2A-3mcqA:
22.92
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.
1E7B_A_HLTA4003_1
(SERUM ALBUMIN)		 3mcq THIAMINE-MONOPHOSPHA
TE KINASE
(Methylobacillus
flagellatus) 		5 / 9 ILE A 291
VAL A 229
GLY A 289
ALA A 227
LEU A 216
 None
 1.18A 1e7bA-3mcqA:
undetectable		 1e7bA-3mcqA:
19.56
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.
1RB3_A_MTXA161_1
(DIHYDROFOLATE
REDUCTASE)		 3mcq THIAMINE-MONOPHOSPHA
TE KINASE
(Methylobacillus
flagellatus) 		5 / 10 ILE A 274
ALA A 202
LEU A 262
ILE A 277
THR A 265
 None
 1.29A 1rb3A-3mcqA:
undetectable		 1rb3A-3mcqA:
21.97
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.
1RJD_A_SAMA801_1
(CARBOXY METHYL
TRANSFERASE FOR
PROTEIN PHOSPHATASE
2A CATALYTIC SUBUNIT)		 3mcq THIAMINE-MONOPHOSPHA
TE KINASE
(Methylobacillus
flagellatus) 		4 / 6 ARG A 170
ASP A 259
TYR A 260
ASP A 207
 None
 1.33A 1rjdA-3mcqA:
undetectable		 1rjdA-3mcqA:
24.18
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.
3W1W_A_CHDA1503_0
(FERROCHELATASE,
MITOCHONDRIAL)		 3mcq THIAMINE-MONOPHOSPHA
TE KINASE
(Methylobacillus
flagellatus) 		4 / 8 ILE A 219
LEU A 220
VAL A 229
GLY A 289
 None
 0.59A 3w1wA-3mcqA:
undetectable		 3w1wA-3mcqA:
20.86
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.
3WRI_A_CAMA502_0
(CAMPHOR
5-MONOOXYGENASE)		 3mcq THIAMINE-MONOPHOSPHA
TE KINASE
(Methylobacillus
flagellatus) 		4 / 5 LEU A 114
GLY A 117
THR A 119
ILE A 126
 None
 0.84A 3wriA-3mcqA:
undetectable		 3wriA-3mcqA:
23.95
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.
3WRI_B_CAMB502_0
(CAMPHOR
5-MONOOXYGENASE)		 3mcq THIAMINE-MONOPHOSPHA
TE KINASE
(Methylobacillus
flagellatus) 		4 / 5 LEU A 114
GLY A 117
THR A 119
ILE A 126
 None
 0.85A 3wriB-3mcqA:
undetectable		 3wriB-3mcqA:
23.95
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.
4I13_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 3mcq THIAMINE-MONOPHOSPHA
TE KINASE
(Methylobacillus
flagellatus) 		5 / 12 ILE A 274
ALA A 202
LEU A 262
LEU A 281
ILE A 277
 None
 1.01A 4i13A-3mcqA:
undetectable		 4i13A-3mcqA:
21.97
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.
4OGR_E_ADNE401_1
(CYCLIN-DEPENDENT
KINASE 9)		 3mcq THIAMINE-MONOPHOSPHA
TE KINASE
(Methylobacillus
flagellatus) 		5 / 7 GLY A 256
ALA A 165
ASP A 258
LEU A 185
ASP A 159
 None
None
PG4  A 327 (-3.1A)
PG4  A 327 ( 4.8A)
None
 1.27A 4ogrE-3mcqA:
undetectable		 4ogrE-3mcqA:
21.23
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.
5ECN_A_LEUA602_0
(JASMONIC ACID-AMIDO
SYNTHETASE JAR1)		 3mcq THIAMINE-MONOPHOSPHA
TE KINASE
(Methylobacillus
flagellatus) 		4 / 7 ALA A 166
TYR A 171
VAL A 239
GLU A 177
 None
 1.03A 5ecnA-3mcqA:
undetectable		 5ecnA-3mcqA:
19.10