Ligand validation:2AES

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
2AES_DIO_C_435	11%	58%	0.232	0.745	0.91	0.7	-	-	2	0	100%	1
3EE5_DIO_C_435	34%	34%	0.157	0.837	0.94	1.66	-	2	1	0	100%	1
2AH9_DIO_A_432	14%	61%	0.28	0.829	0.88	0.61	-	-	4	0	100%	1
2AEC_DIO_C_435	8%	57%	0.208	0.674	0.95	0.7	-	-	2	0	100%	1
2AE7_DIO_C_433	8%	59%	0.295	0.761	0.92	0.66	-	-	2	0	100%	1
2AGD_DIO_C_438	7%	57%	0.219	0.679	0.93	0.71	-	-	2	0	100%	1
6THS_DIO_A_301	100%	88%	0.044	0.988	0.46	0.22	-	-	0	0	100%	1
4DOD_DIO_A_501	99%	57%	0.052	0.982	0.58	1.07	-	1	0	0	100%	1
4DOE_DIO_A_501	98%	40%	0.055	0.976	0.61	1.7	-	1	0	0	100%	1
5MJC_DIO_A_203	98%	52%	0.058	0.978	0.71	1.12	-	1	0	0	100%	1
3WEU_DIO_A_804	97%	48%	0.059	0.973	0.8	1.18	-	1	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.