Ligand validation:3NRR

EDO: 1,2-ETHANEDIOL

	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
3NRR_EDO_A_533	81%	90%	0.084	0.934	0.52	0.1	-	-	0	0	100%	1
3NRR_EDO_B_533	79%	81%	0.09	0.934	0.36	0.45	-	-	0	0	100%	1
3NRR_EDO_A_531	45%	65%	0.131	0.861	0.74	0.61	-	-	0	0	100%	1
3NRR_EDO_A_535	43%	83%	0.113	0.834	0.43	0.35	-	-	0	0	100%	1
3NRR_EDO_B_534	37%	84%	0.119	0.815	0.47	0.29	-	-	0	0	100%	1
3NRR_EDO_B_532	34%	77%	0.185	0.867	0.61	0.32	-	-	2	0	100%	1
3NRR_EDO_B_539	30%	84%	0.157	0.817	0.56	0.22	-	-	0	0	100%	1
3NRR_EDO_A_536	27%	90%	0.164	0.81	0.44	0.19	-	-	0	0	100%	1
3NRR_EDO_A_514	25%	84%	0.18	0.812	0.47	0.29	-	-	0	0	100%	1
3NRR_EDO_B_537	14%	84%	0.167	0.715	0.45	0.31	-	-	1	0	100%	1
3NRR_EDO_A_532	8%	86%	0.167	0.644	0.59	0.15	-	-	1	0	100%	1
3NRR_EDO_A_534	5%	82%	0.19	0.6	0.67	0.15	-	-	0	0	100%	1
3NRR_EDO_A_537	4%	89%	0.252	0.621	0.46	0.19	-	-	0	0	100%	1
3K2H_EDO_B_518	91%	82%	0.075	0.961	0.66	0.16	-	-	4	0	100%	1
2G8S_EDO_A_3016	100%	84%	0.02	0.992	0.42	0.35	-	-	0	0	100%	0.5
3DPJ_EDO_B_195	100%	82%	0.022	0.994	0.47	0.34	-	-	1	0	100%	1
4EYG_EDO_A_402	100%	81%	0.024	0.995	0.44	0.39	-	-	0	0	100%	1
4NMU_EDO_D_206	100%	92%	0.025	0.997	0.38	0.14	-	-	0	0	100%	1
4Q6J_EDO_A_302	100%	82%	0.013	0.999	0.37	0.42	-	-	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.