SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'BXO'


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.
1ZQ9_B_SAMB4001_0
(PROBABLE
DIMETHYLADENOSINE
TRANSFERASE)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		5 / 12 HIS A 320
GLY A 154
GLY A 156
VAL A  96
ILE A 280
 BXO  A 355 (-3.8A)
None
None
None
None
 0.99A 1zq9B-3a18A:
undetectable		 1zq9B-3a18A:
19.84
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.
2QJU_A_DSMA801_1
(TRANSPORTER)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		5 / 11 LEU A 318
LEU A 316
ARG A 317
PHE A 148
ALA A 224
 BXO  A 355 ( 4.9A)
None
None
None
None
 1.07A 2qjuA-3a18A:
undetectable		 2qjuA-3a18A:
20.58
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.
4ZDZ_A_TPFA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		4 / 7 PHE A 307
PHE A  27
GLY A 170
LEU A 145
 None
HEM  A 354 (-4.4A)
HEM  A 354 (-3.5A)
BXO  A 355 ( 4.7A)
 0.95A 4zdzA-3a18A:
undetectable		 4zdzA-3a18A:
21.11
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.
5ESF_A_TPFA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		4 / 8 PHE A 307
PHE A  27
GLY A 170
LEU A 145
 None
HEM  A 354 (-4.4A)
HEM  A 354 (-3.5A)
BXO  A 355 ( 4.7A)
 0.94A 5esfA-3a18A:
undetectable		 5esfA-3a18A:
20.75
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.
6BTX_A_EDTA503_0
(SOLUTE CARRIER
FAMILY 39
(IRON-REGULATED
TRANSPORTER))		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		4 / 7 SER A 174
GLY A 173
ARG A 178
LEU A 145
 HEM  A 354 (-2.9A)
HEM  A 354 (-3.7A)
HEM  A 354 ( 4.2A)
BXO  A 355 ( 4.7A)
 1.04A 6btxA-3a18A:
undetectable		 6btxA-3a18A:
21.35
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.
6EBP_A_DAHA123_0
(RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE,
BETA SUBUNIT)		 3a18 ALDOXIME DEHYDRATASE
(Rhodococcus
erythropolis) 		5 / 9 LEU A 145
THR A 144
SER A 163
ILE A 162
ILE A 166
 BXO  A 355 ( 4.7A)
None
None
None
None
 1.28A 6ebpA-3a18A:
undetectable		 6ebpA-3a18A:
15.56