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PDBsum entry 3dds
Go to PDB code:
Ligand/metal interactions
PDB id
3dds
2 instances of ligand highlighted
CFF
Ligands
NBG
×2
NBG 901(A)
PO4
PO4 902(A)
PLP
×2
PLP 903(A)
CFF
×2
CFF 904(A)
26B
×3
26B 905(A)
26B 906(B)
MPD
MPD 906(A)
MES
MES 904(B)
Ligand
CFF
-
Caffeine
[3,7-Dihydro-1,3,7-Trimethyl-1h-Purine-2,6-Dione]
Formula:
C
8
HNN
4
O
2
Validation of ligand annotation
Per Residue Validation
Atoms
Missing
Incorrect Chiral Centres
Residue
Dic.
Struc.
Link
Subs.
Atoms
Rings
Planar
High
C
Other
CFF 904(A)
14
14
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 CFF
List of
interactions
CFF 904(A)
(also representing equivalent ligand CFF 903(B) )
