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PDBsum entry 5fdx
Go to PDB code:
Ligand/metal interactions
PDB id
5fdx
2 instances of ligand highlighted
5X1
Ligands
5X1
×2
5X1 1001(A)
EDO
×5
EDO 1002(A)
EDO 1003(A)
EDO 1004(A)
EDO 1005(A)
EDO 1002(B)
PEG
×3
PEG 1006(A)
PEG 1003(B)
PEG 1004(B)
Ligand
5X1
-
3-[(4-Methylpiperazin-1-Yl)methyl]-~{N}-[(4~{r})-4- Methyl-
2-Pyrimidin-5-Yl-3,4-Dihydro-1~{h}-Isoquinolin- 7-Yl]-5-
(Trifluoromethyl)benzamide
Formula:
C
28
H
31
F
3
N
6
O
Validation of ligand annotation
Per Residue Validation
Atoms
Missing
Incorrect Chiral Centres
Residue
Dic.
Struc.
Link
Subs.
Atoms
Rings
Planar
High
C
Other
5X1 1001(A)
38
38
0
0
Complete
Chiral checks - OK
Additional Information
Validation carried out using
MotiveValidator
. Full validation report can be found in
Validator
DB
.
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3D Viewers:
LIGPLOT
of interactions involving ligand 5X1
List of
interactions
5X1 1001(A)
(also representing equivalent ligand 5X1 1001(B) )
