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PDBsum entry 1a61
Go to PDB code:
Ligand/metal interactions
PDB id
1a61
Ligand highlighted
00N
Ligands
ASP-PHE-GLU-GLU-
ILE-PRO-GLU-GLU-
TYS-LEU
ASP 355(I) to LEU 364(I)
00N
00N 372(H)
Metals
_NA
×2
NA 650(H)
NA 651(H)
Ligand
00N
-
(1s,7s)-7-Amino-7-Benzyl-N-{(1s)-4-Carbamimidamido-1- [(S)-
Hydroxy(1,3-Thiazol-2-Yl)methyl]butyl}-8- Oxohexahydro-1h-
Pyra zolo[1,2-A]pyridazine-1- Carboxamide
[Mol-127]
Formula:
C
24
H
34
N
8
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
00N 372(H)
36
36
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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of interactions involving ligand 00N
List of
interactions
00N 372(H)
_NA
×2
