Ligand validation:4IE2

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
4IE2_BME_A_406	5%	90%	0.438	0.856	0.24	0.35	-	-	1	0	100%	0.35
4IE2_BME_B_407	2%	80%	0.515	0.818	0.27	0.57	-	-	0	0	100%	0.43
4IE2_BME_B_404	2%	78%	0.551	0.816	0.33	0.55	-	-	1	0	100%	1
4IE2_BME_A_404	1%	91%	0.533	0.709	0.33	0.25	-	-	5	0	100%	1
4IE2_BME_C_405	0%	77%	0.481	0.494	0.25	0.66	-	-	0	0	100%	0.36
4IE2_BME_B_405	0%	50%	0.426	0.037	0.5	1.4	-	-	2	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.