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PDBsum entry 3pec
Go to PDB code:
Ligand/metal interactions
PDB id
3pec
Ligand highlighted
ZYG
Ligands
GOL
×7
GOL 179(A)
GOL 180(A)
GOL 181(A)
GOL 182(A)
GOL 181(C)
GOL 3731(C)
SO4
×3
SO4 183(A)
SO4 186(C)
SO4 187(C)
ZYG
ZYG 188(C)
Metals
_FE
FE 179(C)
_NA
×4
NA 182(C)
NA 183(C)
NA 184(C)
NA 185(C)
Ligand
ZYG
-
9-{Hydroxy[(5s,6r)-6-Hydroxy-6-{[(1s)-3-{[(3s)-1- Hydroxy-
2-Oxoazepan-3-Yl]amino}-1-Methyl-3- Oxopropyl]oxy}-5-
({[(4s)-2-(2-Hydroxyphenyl)-4,5- Dihydro-1,3-Oxazol-4-
Yl]carbonyl}amino)hexyl]amino}-9- Oxononanoic acid
Formula:
C
35
H
53
N
5
O
12
Validation of ligand annotation
Per Residue Validation
Atoms
Missing
Incorrect Chiral Centres
Residue
Dic.
Struc.
Link
Subs.
Atoms
Rings
Planar
High
C
Other
ZYG 188(C)
52
52
0
0
0
0
0
0
1
0
Additional Information
Validation carried out using
MotiveValidator
. Full validation report can be found in
Validator
DB
.
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List of
interactions
ZYG 188(C)
_FE
_NA
×4
