Ligand validation:3DSJ

OCT: N-OCTANE

	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
3DSJ_OCT_A_2	36%	86%	0.134	0.824	0.22	0.5	-	-	0	0	100%	1
3DSJ_OCT_A_1	11%	20%	0.332	0.847	2.42	1.03	3	1	8	0	100%	1
3DSJ_OCT_B_5	6%	53%	0.404	0.847	1.16	0.68	1	-	0	0	100%	1
3DSJ_OCT_A_3	1%	82%	0.266	0.361	0.27	0.52	-	-	0	0	100%	1
3DSI_OCT_B_5	51%	81%	0.106	0.859	0.26	0.56	-	-	0	0	100%	1
3DSK_OCT_B_5	30%	80%	0.11	0.768	0.3	0.53	-	-	0	0	100%	1
6W85_OCT_A_408	89%	78%	0.094	0.972	0.44	0.46	-	-	0	0	100%	1
6W83_OCT_A_405	83%	69%	0.098	0.956	0.43	0.74	-	-	0	0	100%	1
7OUM_OCT_C_1112	76%	100%	0.122	0.958	0.11	0.07	-	-	0	0	100%	1
2WJR_OCT_A_1220	66%	86%	0.119	0.925	0.39	0.33	-	-	0	0	100%	1
6W86_OCT_B_407	65%	72%	0.129	0.932	0.58	0.49	-	-	5	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.