SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4mwa'

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.
1JTX_A_CVIA200_0
(HYPOTHETICAL
TRANSCRIPTIONAL
REGULATOR IN QACA
5'REGION)		 4mwa 4-HYDROXY-3-METHYLBU
T-2-EN-1-YL
DIPHOSPHATE SYNTHASE
(Bacillus
anthracis) 		5 / 12 THR D   5
ILE D 225
ILE D 187
ILE D 132
ALA D 159
 None
 1.28A 1jtxA-4mwaD:
undetectable		 1jtxA-4mwaD:
22.06
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.
1TW4_A_CHDA130_0
(FATTY ACID-BINDING
PROTEIN)		 4mwa 4-HYDROXY-3-METHYLBU
T-2-EN-1-YL
DIPHOSPHATE SYNTHASE
(Bacillus
anthracis) 		5 / 12 LEU D  93
ALA D  92
ILE D  85
ILE D 165
LEU D 166
 None
 0.98A 1tw4A-4mwaD:
undetectable		 1tw4A-4mwaD:
18.68
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.
2JN3_A_JN3A130_1
(FATTY ACID-BINDING
PROTEIN, LIVER)		 4mwa 4-HYDROXY-3-METHYLBU
T-2-EN-1-YL
DIPHOSPHATE SYNTHASE
(Bacillus
anthracis) 		5 / 12 LEU D  93
ALA D  92
ILE D  85
ILE D 165
LEU D 166
 None
 0.94A 2jn3A-4mwaD:
undetectable		 2jn3A-4mwaD:
18.68
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.
2QHF_A_NCAA493_0
(CHORISMATE SYNTHASE)		 4mwa 4-HYDROXY-3-METHYLBU
T-2-EN-1-YL
DIPHOSPHATE SYNTHASE
(Bacillus
anthracis) 		5 / 11 ALA D  66
THR D  36
ALA D  95
ALA D  83
VAL D  59
 None
 1.15A 2qhfA-4mwaD:
undetectable		 2qhfA-4mwaD:
23.21
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.
3N8Z_B_FLPB1701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 4mwa 4-HYDROXY-3-METHYLBU
T-2-EN-1-YL
DIPHOSPHATE SYNTHASE
(Bacillus
anthracis) 		5 / 12 VAL D 183
LEU D 252
ILE D 225
GLY D 223
ALA D 224
 None
 0.86A 3n8zB-4mwaD:
undetectable		 3n8zB-4mwaD:
19.35
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.
3R9T_A_BEZA264_0
(ECHA1_1)		 4mwa 4-HYDROXY-3-METHYLBU
T-2-EN-1-YL
DIPHOSPHATE SYNTHASE
(Bacillus
anthracis) 		4 / 8 ALA D  92
ILE D 105
ALA D 123
ALA D 122
 None
 0.63A 3r9tA-4mwaD:
undetectable		 3r9tA-4mwaD:
24.59
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.
3UM5_B_CP6B709_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 4mwa 4-HYDROXY-3-METHYLBU
T-2-EN-1-YL
DIPHOSPHATE SYNTHASE
(Bacillus
anthracis) 		5 / 10 ILE D 174
VAL D  13
PHE D 171
ILE D  96
ILE D 130
 None
 1.37A 3um5B-4mwaD:
undetectable		 3um5B-4mwaD:
18.09
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.
4Q5M_A_ROCA1101_1
(PROTEASE)		 4mwa 4-HYDROXY-3-METHYLBU
T-2-EN-1-YL
DIPHOSPHATE SYNTHASE
(Bacillus
anthracis) 		5 / 12 GLY D  98
ILE D  73
VAL D  59
ILE D  46
THR D  36
 None
 1.01A 4q5mA-4mwaD:
undetectable		 4q5mA-4mwaD:
23.93
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.
5F1A_B_SALB601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 4mwa 4-HYDROXY-3-METHYLBU
T-2-EN-1-YL
DIPHOSPHATE SYNTHASE
(Bacillus
anthracis) 		4 / 7 VAL D 183
LEU D 252
GLY D 223
ALA D 224
 None
 0.90A 5f1aB-4mwaD:
undetectable		 5f1aB-4mwaD:
19.35
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.
5U4S_B_BEZB301_0
(PUTATIVE SHORT CHAIN
DEHYDROGENASE)		 4mwa 4-HYDROXY-3-METHYLBU
T-2-EN-1-YL
DIPHOSPHATE SYNTHASE
(Bacillus
anthracis) 		4 / 8 SER D 218
ILE D 205
LEU D 222
LEU D 252
 None
 0.96A 5u4sB-4mwaD:
2.1		 5u4sB-4mwaD:
23.71
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.
5X1F_C_CHDC304_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 4mwa 4-HYDROXY-3-METHYLBU
T-2-EN-1-YL
DIPHOSPHATE SYNTHASE
(Bacillus
anthracis) 		4 / 5 ARG D   7
LEU D  26
LEU D 226
PHE D 256
 None
 1.19A 5x1fC-4mwaD:
undetectable
5x1fJ-4mwaD:
undetectable		 5x1fC-4mwaD:
22.33
5x1fJ-4mwaD:
11.91
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.
5XDX_P_CHDP306_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT VIIA-HEART)		 4mwa 4-HYDROXY-3-METHYLBU
T-2-EN-1-YL
DIPHOSPHATE SYNTHASE
(Bacillus
anthracis) 		4 / 5 ARG D   7
LEU D  26
LEU D 226
PHE D 256
 None
 1.26A 5xdxP-4mwaD:
undetectable
5xdxW-4mwaD:
undetectable		 5xdxP-4mwaD:
21.78
5xdxW-4mwaD:
11.91
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.
5Y80_A_IREA402_0
(CYCLIN-G-ASSOCIATED
KINASE)		 4mwa 4-HYDROXY-3-METHYLBU
T-2-EN-1-YL
DIPHOSPHATE SYNTHASE
(Bacillus
anthracis) 		5 / 11 ALA D  92
ASP D 101
VAL D 176
ILE D 175
GLN D  29
 None
 1.25A 5y80A-4mwaD:
undetectable		 5y80A-4mwaD:
17.97
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.
5ZJI_A_PQNA844_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A1
PHOTOSYSTEM I
REACTION CENTER
SUBUNIT IX)		 4mwa 4-HYDROXY-3-METHYLBU
T-2-EN-1-YL
DIPHOSPHATE SYNTHASE
(Bacillus
anthracis) 		5 / 10 GLY D  53
ILE D 236
ALA D 249
LEU D 253
PHE D 197
 None
 1.44A 5zjiA-4mwaD:
undetectable
5zjiJ-4mwaD:
undetectable		 5zjiA-4mwaD:
14.07
5zjiJ-4mwaD:
9.13
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.
6GNA_A_ACTA307_0
(THIOREDOXIN
REDUCTASE)		 4mwa 4-HYDROXY-3-METHYLBU
T-2-EN-1-YL
DIPHOSPHATE SYNTHASE
(Bacillus
anthracis) 		3 / 3 ARG D 131
LYS D 179
TYR D 190
 None
 0.44A 6gnaA-4mwaD:
undetectable		 6gnaA-4mwaD:
22.46
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.
6GNB_A_ACTA307_0
(THIOREDOXIN
REDUCTASE)		 4mwa 4-HYDROXY-3-METHYLBU
T-2-EN-1-YL
DIPHOSPHATE SYNTHASE
(Bacillus
anthracis) 		3 / 3 ARG D 131
LYS D 179
TYR D 190
 None
 0.44A 6gnbA-4mwaD:
undetectable		 6gnbA-4mwaD:
22.46
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.
6NMF_W_CHDW101_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 4mwa 4-HYDROXY-3-METHYLBU
T-2-EN-1-YL
DIPHOSPHATE SYNTHASE
(Bacillus
anthracis) 		4 / 6 ILE D 163
LEU D 160
ARG D 131
MET D 178
 None
 1.01A 6nmfN-4mwaD:
undetectable
6nmfW-4mwaD:
undetectable		 6nmfN-4mwaD:
21.17
6nmfW-4mwaD:
11.91