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PDBsum entry 2amd
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Ligand/metal interactions
PDB id
2amd
2 instances of ligand highlighted
9IN
Ligands
9IN
×2
9IN 1001(A)
Ligand
9IN
-
N-(3-Furoyl)-D-Valyl-L-Valyl-N~1~-((1r,2z)-4-Ethoxy-4- Oxo-
1-{[(3s)-2-Oxopyrrolidin-3-Yl]methyl}but-2-Enyl)- D-
Leucinamide
[(E)-(4s,6s)-6-((S)-2-{(S)-2-[(Furan-2-Carbonyl)-Amino]- 3-
Methyl-Butyrylamino}-3-Methyl-Butyrylamino)-8- Methyl-5-
Oxo-4-((R)-2-Oxo-Pyrrolidin-3-Ylmethyl)-Non- 2-
Enoic acid ethyl ester]
Formula:
C
32
H
49
N
5
O
8
Validation of ligand annotation
Per Residue Validation
Atoms
Missing
Incorrect Chiral Centres
Residue
Dic.
Struc.
Link
Subs.
Atoms
Rings
Planar
High
C
Other
9IN 1001(A)
45
45
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 9IN
List of
interactions
9IN 1001(A)
(also representing equivalent ligand 9IN 2001(B) )
