Ligand validation:3B1D

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
3B1D_EPE_C_601	65%	55%	0.102	0.904	0.7	1.02	1	1	0	0	100%	1
3B1D_EPE_A_603	57%	54%	0.124	0.898	0.81	0.97	1	2	0	0	100%	1
3B1D_EPE_D_602	52%	47%	0.14	0.896	0.9	1.15	1	2	0	0	100%	1
3B1D_EPE_D_603	50%	9%	0.144	0.893	1.98	2.45	1	3	0	0	100%	0.27
3B1D_EPE_B_601	49%	46%	0.122	0.867	0.77	1.3	1	2	0	0	100%	1
3B1D_EPE_B_602	49%	17%	0.158	0.903	1.78	1.84	1	4	0	0	100%	0.27
3B1D_EPE_D_601	33%	49%	0.141	0.817	0.81	1.14	1	2	0	0	100%	1
3B1D_EPE_C_603	33%	52%	0.203	0.88	0.86	1.01	1	1	0	0	100%	0.27
3B1D_EPE_C_602	28%	17%	0.211	0.863	1.73	1.89	1	2	0	0	100%	0.27
3B1D_EPE_A_602	28%	44%	0.174	0.824	0.96	1.2	1	1	0	0	100%	1
3B1D_EPE_A_601	27%	48%	0.155	0.801	0.65	1.34	1	3	1	0	100%	1
3B1E_EPE_A_501	95%	56%	0.06	0.965	0.5	1.17	-	2	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
1CZB_EPE_A_300	100%	65%	0.04	0.991	0.69	0.67	-	-	0	0	100%	1
8VCQ_EPE_F_201	100%	60%	0.044	0.984	0.85	0.68	1	-	1	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.