SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4bms'

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.
1E7B_A_HLTA4003_1
(SERUM ALBUMIN)		 4bms ALCLOHOL
DEHYDROGENASE/SHORT-
CHAIN DEHYDROGENASE
(Ralstonia
sp.
DSMZ
6428) 		5 / 9 LEU A  84
VAL A  36
GLY A  13
ALA A  59
LEU A  70
 None
None
NAP  A1250 (-3.1A)
None
None
 1.17A 1e7bA-4bmsA:
undetectable		 1e7bA-4bmsA:
18.29
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.
1FDS_A_ESTA350_1
(17-BETA-HYDROXYSTERO
ID-DEHYDROGENASE)		 4bms ALCLOHOL
DEHYDROGENASE/SHORT-
CHAIN DEHYDROGENASE
(Ralstonia
sp.
DSMZ
6428) 		5 / 12 SER A 137
VAL A 138
LEU A 144
TYR A 150
GLY A 181
 NAP  A1250 (-3.1A)
None
None
NAP  A1250 (-4.8A)
NAP  A1250 (-4.9A)
 0.61A 1fdsA-4bmsA:
28.0		 1fdsA-4bmsA:
28.57
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.
1FDU_A_ESTA351_1
(17-BETA-HYDROXYSTERO
ID DEHYDROGENASE)		 4bms ALCLOHOL
DEHYDROGENASE/SHORT-
CHAIN DEHYDROGENASE
(Ralstonia
sp.
DSMZ
6428) 		5 / 12 SER A 137
VAL A 138
LEU A 144
TYR A 150
GLY A 181
 NAP  A1250 (-3.1A)
None
None
NAP  A1250 (-4.8A)
NAP  A1250 (-4.9A)
 0.60A 1fduA-4bmsA:
28.1		 1fduA-4bmsA:
28.57
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.
1FDU_B_ESTB354_1
(17-BETA-HYDROXYSTERO
ID DEHYDROGENASE)		 4bms ALCLOHOL
DEHYDROGENASE/SHORT-
CHAIN DEHYDROGENASE
(Ralstonia
sp.
DSMZ
6428) 		4 / 8 SER A 137
VAL A 138
LEU A 144
TYR A 150
 NAP  A1250 (-3.1A)
None
None
NAP  A1250 (-4.8A)
 0.84A 1fduB-4bmsA:
28.1		 1fduB-4bmsA:
28.57
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.
1FDU_C_ESTC353_1
(17-BETA-HYDROXYSTERO
ID DEHYDROGENASE)		 4bms ALCLOHOL
DEHYDROGENASE/SHORT-
CHAIN DEHYDROGENASE
(Ralstonia
sp.
DSMZ
6428) 		5 / 12 SER A 137
VAL A 138
LEU A 144
TYR A 150
GLY A 181
 NAP  A1250 (-3.1A)
None
None
NAP  A1250 (-4.8A)
NAP  A1250 (-4.9A)
 0.58A 1fduC-4bmsA:
28.0		 1fduC-4bmsA:
28.57
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.
1IOL_A_ESTA400_1
(ESTROGENIC 17-BETA
HYDROXYSTEROID
DEHYDROGENASE)		 4bms ALCLOHOL
DEHYDROGENASE/SHORT-
CHAIN DEHYDROGENASE
(Ralstonia
sp.
DSMZ
6428) 		5 / 11 SER A 137
VAL A 138
LEU A 144
TYR A 150
GLY A 181
 NAP  A1250 (-3.1A)
None
None
NAP  A1250 (-4.8A)
NAP  A1250 (-4.9A)
 0.42A 1iolA-4bmsA:
27.0		 1iolA-4bmsA:
28.27
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.
2J9C_A_ACTA1121_0
(HYPOTHETICAL
NITROGEN REGULATORY
PII-LIKE PROTEIN
MJ0059)		 4bms ALCLOHOL
DEHYDROGENASE/SHORT-
CHAIN DEHYDROGENASE
(Ralstonia
sp.
DSMZ
6428) 		4 / 5 VAL A 235
SER A 131
VAL A 175
SER A 232
 None
 1.19A 2j9cA-4bmsA:
undetectable
2j9cB-4bmsA:
undetectable
2j9cC-4bmsA:
undetectable		 2j9cA-4bmsA:
19.48
2j9cB-4bmsA:
19.48
2j9cC-4bmsA:
19.48
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.
2QEU_A_ACTA142_0
(PUTATIVE
CARBOXYMUCONOLACTONE
DECARBOXYLASE)		 4bms ALCLOHOL
DEHYDROGENASE/SHORT-
CHAIN DEHYDROGENASE
(Ralstonia
sp.
DSMZ
6428) 		4 / 5 GLU A 219
PRO A 217
ILE A 183
GLY A 215
 None
None
NAP  A1250 (-4.8A)
None
 1.20A 2qeuA-4bmsA:
undetectable
2qeuC-4bmsA:
undetectable		 2qeuA-4bmsA:
23.69
2qeuC-4bmsA:
23.69
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.
3CZH_A_D2VA602_1
(CYTOCHROME P450 2R1)		 4bms ALCLOHOL
DEHYDROGENASE/SHORT-
CHAIN DEHYDROGENASE
(Ralstonia
sp.
DSMZ
6428) 		5 / 12 THR A 247
PHE A 205
VAL A 214
ALA A 208
THR A 185
 None
None
None
None
NAP  A1250 (-2.6A)
 1.12A 3czhA-4bmsA:
undetectable		 3czhA-4bmsA:
22.51
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.
3DL9_B_V2HB602_0
(CYTOCHROME P450 2R1)		 4bms ALCLOHOL
DEHYDROGENASE/SHORT-
CHAIN DEHYDROGENASE
(Ralstonia
sp.
DSMZ
6428) 		5 / 12 THR A 247
PHE A 205
VAL A 214
ALA A 208
THR A 185
 None
None
None
None
NAP  A1250 (-2.6A)
 1.12A 3dl9B-4bmsA:
undetectable		 3dl9B-4bmsA:
22.51
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.
3JB2_A_SAMA1102_1
(STRUCTURAL PROTEIN
VP3)		 4bms ALCLOHOL
DEHYDROGENASE/SHORT-
CHAIN DEHYDROGENASE
(Ralstonia
sp.
DSMZ
6428) 		3 / 3 ARG A 113
ASP A  60
ASP A 109
 None
NAP  A1250 (-3.3A)
None
 0.90A 3jb2A-4bmsA:
3.5		 3jb2A-4bmsA:
13.58
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.
4C9N_B_CAMB1420_0
(CYTOCHROME P450)		 4bms ALCLOHOL
DEHYDROGENASE/SHORT-
CHAIN DEHYDROGENASE
(Ralstonia
sp.
DSMZ
6428) 		5 / 10 THR A 135
THR A 118
GLY A  13
VAL A 110
VAL A  61
 NAP  A1250 (-4.1A)
None
NAP  A1250 (-3.1A)
NAP  A1250 (-4.9A)
NAP  A1250 (-3.7A)
 1.35A 4c9nB-4bmsA:
undetectable		 4c9nB-4bmsA:
21.70
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.
4C9P_A_CAMA423_0
(CYTOCHROME P450)		 4bms ALCLOHOL
DEHYDROGENASE/SHORT-
CHAIN DEHYDROGENASE
(Ralstonia
sp.
DSMZ
6428) 		5 / 9 THR A 135
THR A 118
GLY A  13
VAL A 110
VAL A  61
 NAP  A1250 (-4.1A)
None
NAP  A1250 (-3.1A)
NAP  A1250 (-4.9A)
NAP  A1250 (-3.7A)
 1.36A 4c9pA-4bmsA:
undetectable		 4c9pA-4bmsA:
21.70
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.
4C9P_B_CAMB423_0
(CYTOCHROME P450)		 4bms ALCLOHOL
DEHYDROGENASE/SHORT-
CHAIN DEHYDROGENASE
(Ralstonia
sp.
DSMZ
6428) 		5 / 10 THR A 135
THR A 118
GLY A  13
VAL A 110
VAL A  61
 NAP  A1250 (-4.1A)
None
NAP  A1250 (-3.1A)
NAP  A1250 (-4.9A)
NAP  A1250 (-3.7A)
 1.35A 4c9pB-4bmsA:
undetectable		 4c9pB-4bmsA:
21.70
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.
4DCM_A_SAMA401_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE G)		 4bms ALCLOHOL
DEHYDROGENASE/SHORT-
CHAIN DEHYDROGENASE
(Ralstonia
sp.
DSMZ
6428) 		5 / 11 ALA A  46
GLY A  13
GLY A  37
ILE A  35
ASN A 111
 None
NAP  A1250 (-3.1A)
NAP  A1250 (-3.5A)
None
None
 1.01A 4dcmA-4bmsA:
6.5		 4dcmA-4bmsA:
23.81
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.
4FFW_B_715B801_2
(DIPEPTIDYL PEPTIDASE
4)		 4bms ALCLOHOL
DEHYDROGENASE/SHORT-
CHAIN DEHYDROGENASE
(Ralstonia
sp.
DSMZ
6428) 		3 / 3 ARG A 171
TYR A 234
ASN A 176
 None
 0.89A 4ffwB-4bmsA:
undetectable		 4ffwB-4bmsA:
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.
4OR0_A_NPSA602_1
(SERUM ALBUMIN)		 4bms ALCLOHOL
DEHYDROGENASE/SHORT-
CHAIN DEHYDROGENASE
(Ralstonia
sp.
DSMZ
6428) 		5 / 9 PHE A 226
ALA A 223
ALA A 221
SER A 232
LEU A 227
 None
 1.34A 4or0A-4bmsA:
undetectable		 4or0A-4bmsA:
17.67
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.
5EAJ_B_FOLB201_0
(DIHYDROFOLATE
REDUCTASE)		 4bms ALCLOHOL
DEHYDROGENASE/SHORT-
CHAIN DEHYDROGENASE
(Ralstonia
sp.
DSMZ
6428) 		5 / 12 LEU A  70
THR A   8
ILE A  81
LEU A 125
PRO A 124
 None
 0.98A 5eajB-4bmsA:
2.3		 5eajB-4bmsA:
21.07
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.
5HSW_A_ACTA501_0
(ORF 37)		 4bms ALCLOHOL
DEHYDROGENASE/SHORT-
CHAIN DEHYDROGENASE
(Ralstonia
sp.
DSMZ
6428) 		4 / 5 SER A 136
SER A 137
SER A 179
SER A 151
 None
NAP  A1250 (-3.1A)
None
None
 1.27A 5hswA-4bmsA:
undetectable		 5hswA-4bmsA:
20.29