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PDBsum entry 4aqc
Go to PDB code:
Ligand/metal interactions
PDB id
4aqc
2 instances of ligand highlighted
88A
Ligands
88A
×2
88A 2001(A)
SO4
×5
SO4 2002(A)
SO4 2003(B)
SO4 2004(B)
SO4 2005(B)
Ligand
88A
-
8-(4-Methylsulfonylphenyl)-N-(4-Morpholin-4-Ylphenyl)-
[1,2,4]triazolo[1,5-A]pyridin-2-Amine
[[8-(4-Methanesulfonyl-Phenyl)-[1,2,4]triazolo[1,5-
A]pyridin-2-Yl]-(4-Morpholin-4-Yl-Phenyl)-Amine]
Formula:
C
23
H
23
N
5
O
3
S
Validation of ligand annotation
Per Residue Validation
Atoms
Missing
Incorrect Chiral Centres
Residue
Dic.
Struc.
Link
Subs.
Atoms
Rings
Planar
High
C
Other
88A 2001(A)
32
32
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 88A
List of
interactions
88A 2001(A)
(also representing equivalent ligand 88A 2001(B) )
