Ligand validation:3B1E

EPE: 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID

	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
3B1E_EPE_A_501	95%	56%	0.06	0.965	0.5	1.17	-	2	0	0	100%	1
3B1E_EPE_C_501	95%	60%	0.059	0.964	0.61	0.93	-	-	0	0	100%	1
3B1E_EPE_B_501	95%	56%	0.061	0.966	0.65	1.02	1	1	0	0	100%	1
3B1E_EPE_D_501	90%	59%	0.069	0.951	0.69	0.89	1	-	0	0	100%	1
3B1E_EPE_C_502	82%	53%	0.099	0.953	0.77	1.05	1	1	0	0	100%	1
3B1E_EPE_D_502	79%	53%	0.106	0.953	0.76	1.04	1	-	0	0	100%	1
3B1E_EPE_A_502	67%	49%	0.119	0.928	0.87	1.08	1	2	0	0	100%	1
3B1E_EPE_C_503	66%	51%	0.122	0.927	0.77	1.1	1	3	0	0	100%	1
3B1E_EPE_B_502	58%	55%	0.126	0.904	0.65	1.09	1	3	0	0	100%	1
3B1E_EPE_D_503	51%	20%	0.151	0.904	1.68	1.71	1	2	0	0	100%	0.2667
3B1E_EPE_A_503	39%	52%	0.152	0.858	0.81	1.03	1	1	0	0	100%	1
3B1D_EPE_C_601	56%	55%	0.154	0.926	0.7	1.02	1	1	0	0	100%	1
1XX1_EPE_C_2003	100%	37%	0.024	0.996	0.73	1.72	1	4	1	0	100%	1
3EC7_EPE_E_401	100%	10%	0.031	0.993	1.1	3.18	1	11	1	0	100%	1
2BDU_EPE_B_402	100%	29%	0.033	0.993	0.87	1.95	1	5	0	0	100%	1
3R7A_EPE_B_301	99%	39%	0.053	0.987	0.79	1.56	1	4	1	0	100%	1
4WX4_EPE_A_302	99%	53%	0.064	0.994	0.99	0.82	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.