Ligand validation:5NIW

DIO: 1,4-DIETHYLENE DIOXIDE

	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
5NIW_DIO_A_616	86%	66%	0.091	0.961	0.49	0.81	-	-	0	0	100%	0.5
5NIW_DIO_A_613	85%	67%	0.093	0.959	0.7	0.57	-	-	0	0	100%	1
5NIW_DIO_A_611	75%	55%	0.106	0.939	0.53	1.18	-	-	4	0	100%	1
5NIW_DIO_A_619	64%	43%	0.123	0.922	0.77	1.41	-	1	1	0	100%	1
5NIW_DIO_A_612	45%	32%	0.139	0.87	0.47	2.16	-	2	1	0	100%	1
5NIW_DIO_A_614	42%	57%	0.164	0.883	0.76	0.9	-	-	0	0	100%	1
5NIW_DIO_A_615	42%	56%	0.159	0.876	0.51	1.16	-	-	0	0	100%	1
5NIW_DIO_A_622	34%	78%	0.186	0.87	0.52	0.38	-	-	1	0	100%	1
5NIW_DIO_A_621	30%	71%	0.203	0.867	0.48	0.64	-	-	0	0	100%	1
5NIW_DIO_A_620	23%	57%	0.202	0.823	0.58	1.08	-	1	1	0	100%	1
5NIW_DIO_A_617	17%	41%	0.193	0.774	0.95	1.33	-	-	0	0	100%	1
5NIW_DIO_A_618	12%	51%	0.228	0.758	0.79	1.09	-	-	0	0	100%	1
5NIT_DIO_A_621	80%	66%	0.09	0.937	0.5	0.8	-	-	2	0	100%	1
9IKP_DIO_A_201	100%	79%	0.021	0.995	0.62	0.26	-	-	0	0	100%	1
9IL3_DIO_B_202	100%	71%	0.024	0.996	0.71	0.42	-	-	0	0	100%	1
9ILA_DIO_A_201	100%	75%	0.02	0.995	0.59	0.38	-	-	0	0	100%	1
9ILF_DIO_A_201	100%	74%	0.021	0.995	0.53	0.48	-	-	2	0	100%	1
6THS_DIO_A_301	100%	88%	0.044	0.988	0.46	0.22	-	-	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.