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PDBsum entry 2aoc
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Ligand/metal interactions
PDB id
2aoc
Ligand highlighted
2NC
Ligands
UNX
UNX 401(A)
DMS
×3
DMS 601(A)
DMS 603(A)
DMS 604(A)
GOL
×2
GOL 701(A)
GOL 702(B)
2NC
2NC 400(B)
Metals
_NA
NA 500(A)
_CL
×3
CL 503(A)
CL 501(B)
CL 502(B)
Ligand
2NC
-
N-{(2s)-2-[(N-Acetyl-L-Threonyl-L-Isoleucyl) amino]hexyl}-
L-Norleucyl-L-Glutaminyl-N~5~- [Amino(iminio)methyl]-L-
Ornithinamide
[P2/nc]
Formula:
C
35
H
68
N
11
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
2NC 400(B)
54
54
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 2NC
List of
interactions
2NC 400(B)
_NA
