Ligand validation:1PKW

GSH: GLUTATHIONE

GSH is a Ligand Of Interest in 1PKW designated by the RCSB

	Best-fitted instance in this entry
	Other instances in this entry

	Best-fitted instance in this entry
	Best-fitted PDB instances with same target (top 5)

	Best-fitted instance in this entry
	Best-fitted PDB instances with different target (top 5)

Identifier	Ranking for goodness of fit	Ranking for geometry	Real space R factor	Real space correlation coefficient	RMSZ-bond-length	RMSZ-bond-angle	Outliers of bond length	Outliers of bond angle	Atomic clashes	Stereochemical errors	Model completeness	Average occupancy
1PKW_GSH_A_654	96%	49%	0.072	0.979	0.75	1.2	-	3	0	0	100%	1
1PKW_GSH_B_655	94%	52%	0.076	0.976	0.86	1.01	-	1	0	0	100%	1
1GSE_GSH_B_223	93%	56%	0.075	0.968	0.92	0.77	-	-	0	0	100%	1
6ATO_GSH_B_301	89%	36%	0.074	0.954	1.23	1.28	2	2	0	0	100%	1
1USB_GSH_B_1001	75%	8%	0.102	0.936	3.28	1.37	4	4	0	0	100%	1
4ACS_GSH_A_230	69%	50%	0.116	0.93	0.73	1.19	1	5	2	1	100%	1
2WJU_GSH_D_230	48%	10%	0.168	0.911	3.17	1.17	2	3	0	1	100%	1
1V40_GSH_C_3600	100%	46%	0.028	0.992	1.17	0.93	1	-	1	0	100%	1
3R2Q_GSH_A_301	100%	42%	0.036	0.992	1.11	1.13	1	2	0	0	100%	0.952
7JR8_GSH_B_202	100%	32%	0.044	0.996	1.49	1.2	2	1	0	0	100%	1
8AGQ_GSH_A_301	100%	52%	0.046	0.99	0.91	0.96	-	-	0	0	100%	1
4MF6_GSH_A_301	99%	52%	0.051	0.99	1.16	0.72	2	-	0	0	100%	1

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.