PDBsum entry 1d6w

Ligand/metal interactions

PDB id

1d6w


	Ligand highlighted
	00R

Ligands

ASP-PHE-GLU-GLU-
ILE-PRO-GLU-GLU-
TYS-LEU

ASP 355(I) to LEU 364(I)

00R

00R 380(A)

Metals

_NA ×2

NA 950(A)

NA 951(A)

Ligand 00R - (5s)-N-[Trans-4-(2-Amino-1h-Imidazol-5-Yl)cyclohexyl]- 1,3-
Dioxo-2-[2-(Phenylsulfonyl)ethyl]-2,3,5,8- Tetrahydro-1h-
[1,2,4]triazolo[1,2-A]pyridazine-5- Carboxamide
Formula: C₂₄H₂₉N₇O₅S

Validation of ligand annotation

Per Residue Validation

	Atoms				Missing		Incorrect Chiral Centres
Residue	Dic.	Struc.	Link	Subs.	Atoms	Rings	Planar	High	C	Other
00R 380(A)	37	37	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 00R

List of
interactions

00R 380(A)