PDBsum entry 3csh

Ligand/metal interactions

PDB id

3csh


	2 instances of ligand highlighted
	LZ6

Ligands

MES ×2

MES 211(A)

LZ6 ×2

LZ6 212(A)

GSH ×2

GSH 213(A)

SO4

SO4 211(B)

Metals

_CL ×2

CL 210(A)

_CA

CA 210(B)

Ligand LZ6 - L-Gamma-Glutamyl-S-(2-{[4-(3-Carboxypropyl)phenyl](2-
Chloroethyl)amino}ethyl)-L-Cysteinylglycine
[Chlorambucil-Glutathione conjugate]
Formula: C₂₄H₃₅ClN₄O₈S

Validation of ligand annotation

Per Residue Validation

	Atoms				Missing		Incorrect Chiral Centres
Residue	Dic.	Struc.	Link	Subs.	Atoms	Rings	Planar	High	C	Other
LZ6 212(A)	38	38	0	0	Complete		Chiral checks - OK

Advanced Analysis

Residue	Name Mismatches	Count
LZ6 212(A)	O26: O27\|O27: O26	2

Additional Information

Validation carried out using MotiveValidator. Full validation report can be found in Validator^DB.

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Ligand matches this enzyme's reactant glutathione with similarity 52.63%

LIGPLOT of interactions involving ligand LZ6

List of
interactions

LZ6 212(A)

(also representing equivalent ligand LZ6 214(B) )