Ligand validation:4IE3

BME: BETA-MERCAPTOETHANOL

	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
4IE3_BME_B_404	24%	75%	0.222	0.85	0.35	0.61	-	-	2	0	100%	1
4IE3_BME_B_405	18%	89%	0.26	0.851	0.46	0.19	-	-	1	0	100%	1
4IE3_BME_A_404	12%	90%	0.254	0.78	0.35	0.26	-	-	1	0	100%	1
4IE3_BME_C_404	12%	80%	0.288	0.813	0.27	0.56	-	-	1	0	100%	1
4HZE_BME_A_404	98%	84%	0.059	0.98	0.33	0.43	-	-	0	0	100%	0.85
4I06_BME_A_404	98%	88%	0.063	0.984	0.38	0.29	-	-	1	0	100%	0.93
6Q39_BME_B_404	90%	75%	0.085	0.969	0.4	0.58	-	-	0	0	100%	0.94
4IXV_BME_B_404	86%	81%	0.095	0.965	0.33	0.48	-	-	0	0	100%	0.77
6Q37_BME_A_404	76%	74%	0.104	0.941	0.43	0.57	-	-	0	0	100%	0.89
1E46_BME_P_302	100%	59%	0.026	0.993	0.51	1.03	-	-	0	0	100%	1
1DYF_BME_A_179	100%	79%	0.029	0.992	0.55	0.33	-	-	0	0	100%	1
1L56_BME_A_165	100%	74%	0.025	0.989	0.84	0.18	-	-	1	0	100%	1
1L73_BME_A_900	100%	77%	0.025	0.986	0.33	0.57	-	-	1	0	100%	1
1DYG_BME_A_179	100%	74%	0.033	0.991	0.57	0.44	-	-	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.