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PDBsum entry 4be2
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Ligand/metal interactions
PDB id
4be2
Ligand highlighted
XZ2
Ligands
SO4
×3
SO4 1376(A)
SO4 1382(A)
SO4 1300(B)
GOL
×5
GOL 1377(A)
GOL 1378(A)
GOL 1379(A)
GOL 1383(A)
GOL 1301(B)
XZ2
XZ2 1018(D)
Metals
_MG
×3
MG 1302(B)
MG 1380(A)
MG 1381(A)
_ZN
ZN 393(A)
Ligand
XZ2
-
2-(3-Chloro-4-Fluorobenzyl)-6,7-Dihydroxy-N,N-Dimethyl- 1-
Oxo-2,3-Dihydro-1h-Isoindole-4-Sulfonamide
Formula:
C
17
H
16
ClFN
2
O
5
S
Validation of ligand annotation
Per Residue Validation
Atoms
Missing
Incorrect Chiral Centres
Residue
Dic.
Struc.
Link
Subs.
Atoms
Rings
Planar
High
C
Other
XZ2 1018(D)
27
27
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 XZ2
List of
interactions
XZ2 1018(D)
_MG
×3
_ZN
