Ligand validation:3I6A

GSH: GLUTATHIONE

GSH is a Ligand Of Interest in 3I6A 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
3I6A_GSH_D_5104	90%	47%	0.078	0.962	0.84	1.21	-	2	0	0	100%	1
3I6A_GSH_B_5102	88%	43%	0.079	0.954	0.92	1.31	1	2	0	0	100%	1
3I6A_GSH_A_5101	86%	46%	0.081	0.95	0.78	1.3	-	3	2	0	100%	1
3I6A_GSH_H_5108	86%	47%	0.083	0.951	0.95	1.1	1	3	0	0	100%	1
3I6A_GSH_C_5103	85%	44%	0.086	0.952	0.84	1.34	-	3	0	0	100%	1
3I6A_GSH_E_5105	82%	56%	0.08	0.935	0.77	0.93	-	1	1	0	100%	1
3I6A_GSH_G_5107	78%	38%	0.091	0.932	0.94	1.55	1	5	0	0	100%	1
3I6A_GSH_F_5106	73%	53%	0.098	0.924	0.79	1.04	-	2	0	0	100%	1
3I69_GSH_B_5102	34%	81%	0.186	0.868	0.33	0.48	-	-	0	0	100%	1
3R2Q_GSH_A_301	100%	43%	0.036	0.992	1.01	1.23	1	2	0	0	100%	0.952
7JR8_GSH_B_202	100%	28%	0.044	0.996	1.58	1.48	2	3	0	0	100%	1
4I2U_GSH_A_201	100%	65%	0.041	0.988	0.43	0.9	-	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 National Science Foundation (DBI-1832184), 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 R01GM133198.