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PDBsum entry 1y2c
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Ligand/metal interactions
PDB id
1y2c
2 instances of ligand highlighted
3DE
Ligands
3DE
×2
3DE 1003(A)
EDO
×23
EDO 502(A)
EDO 504(A)
EDO 507(A)
EDO 512(A)
EDO 515(A)
EDO 516(A)
EDO 520(A)
EDO 522(A)
EDO 524(A)
EDO 533(A)
EDO 501(B)
EDO 506(B)
EDO 527(B)
EDO 528(B)
EDO 530(B)
EDO 540(B)
Metals
_ZN
×2
ZN 1001(A)
_MG
×2
MG 1002(A)
Ligand
3DE
-
3,5-Dimethyl-1-Phenyl-1h-Pyrazole-4-
Carboxylic acid ethyl ester
Formula:
C
14
H
17
N
2
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
3DE 1003(A)
18
18
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 3DE
List of
interactions
3DE 1003(A)
(also representing equivalent ligand 3DE 1003(B) )
_ZN
×2
_MG
×2
