Ligand validation:3PGR

C8E: (HYDROXYETHYLOXY)TRI(ETHYLOXY)OCTANE

C8E is a Ligand Of Interest in 3PGR 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
3PGR_C8E_A_430	23%	84%	0.19	0.914	0.28	0.47	-	-	0	0	43%	0.4286
3PGR_C8E_A_429	19%	84%	0.257	0.911	0.43	0.33	-	-	0	0	67%	0.6667
3PGR_C8E_A_433	11%	81%	0.268	0.886	0.47	0.34	-	-	0	0	48%	0.4762
3PGR_C8E_A_434	9%	77%	0.329	0.942	0.39	0.51	-	-	0	0	33%	0.3333
3PGR_C8E_A_431	8%	81%	0.3	0.765	0.42	0.39	-	-	0	0	100%	0.97
3PGR_C8E_A_500	7%	86%	0.386	0.834	0.38	0.33	-	-	0	0	100%	0.49
3PGR_C8E_A_432	5%	85%	0.34	0.827	0.44	0.3	-	-	0	0	57%	0.5714
3PGR_C8E_A_435	2%	78%	0.352	0.728	0.41	0.48	-	-	1	0	43%	0.4286
3PGR_C8E_A_436	1%	73%	0.409	0.712	0.44	0.59	-	-	11	0	57%	0.5714
3PGR_C8E_A_428	0%	87%	0.514	0.534	0.46	0.24	-	-	2	0	100%	1
3PGU_C8E_A_449	16%	86%	0.174	0.792	0.44	0.27	-	-	0	0	71%	0.7143
1T16_C8E_B_434	7%	29%	0.319	0.774	0.9	2.03	-	6	4	0	100%	1
2R8A_C8E_B_503	1%	34%	0.556	0.785	0.75	1.96	-	6	2	0	100%	1
5FOK_C8E_A_1725	80%	74%	0.099	0.949	0.47	0.53	-	-	2	0	100%	1
6EHD_C8E_A_409	64%	60%	0.105	0.903	0.41	1.08	-	2	3	0	100%	1
5MDO_C8E_B_404	61%	73%	0.118	0.908	0.36	0.65	-	-	0	0	100%	1
5DL7_C8E_A_506	61%	47%	0.123	0.912	0.72	1.34	-	3	4	0	100%	1
6HCP_C8E_C_824	59%	77%	0.116	0.924	0.46	0.46	-	-	1	0	86%	0.8571

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.