PDBsum entry 3su0

Ligand/metal interactions

PDB id

3su0


	Ligand highlighted
	TSV

Ligands

TSV

TSV 100(A)

SO4

SO4 1(A)

Metals

_ZN

ZN 1181(A)

Ligand TSV - (2r,6s,12z,13as,14ar,16as)-6-[(Tert-Butoxycarbonyl) amino]-
14a-[(Cyclopropylsulfonyl)carbamoyl]-5,16- Dioxo-
1,2,3,5,6,7,8 ,9,10,11,13a,14,14a,15,16,16a-
Hexadecahydrocyclopropa[e]pyrrolo[1,2-
A][1, 4]diazacyclopentadecin-2-Yl 4-Fluoro-2h-Isoindole-2-
Carboxylate
[Itmn-191; danoprevir]
Formula: C₃₅H₄₄FN₅O₉S

Validation of ligand annotation

Per Residue Validation

	Atoms				Missing		Incorrect Chiral Centres
Residue	Dic.	Struc.	Link	Subs.	Atoms	Rings	Planar	High	C	Other
TSV 100(A)	51	51	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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LIGPLOT of interactions involving ligand TSV

List of
interactions

TSV 100(A)