Ligand validation:4DWV

MRD: (4R)-2-METHYLPENTANE-2,4-DIOL

	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
4DWV_MRD_A_380	70%	83%	0.124	0.94	0.25	0.52	-	-	0	0	100%	1
4DWV_MRD_A_381	38%	74%	0.167	0.869	0.25	0.75	-	-	0	0	100%	1
4DWV_MRD_B_379	35%	85%	0.185	0.872	0.31	0.42	-	-	1	0	100%	1
4DWV_MRD_A_379	13%	62%	0.189	0.732	0.42	1	-	-	0	0	100%	0.65
4NFH_MRD_A_380	87%	55%	0.081	0.952	0.23	1.46	-	1	0	0	100%	1
5KJC_MRD_A_380	84%	60%	0.087	0.947	0.3	1.19	-	1	0	0	100%	1
5KJ6_MRD_A_380	82%	54%	0.095	0.951	0.35	1.39	-	1	0	0	100%	1
6OWP_MRD_A_406	79%	91%	0.098	0.943	0.15	0.42	-	-	0	0	100%	0.51
5KCZ_MRD_A_380	78%	77%	0.09	0.932	0.16	0.73	-	-	0	0	100%	1
5SZD_MRD_A_102	98%	93%	0.06	0.984	0.3	0.17	-	-	0	0	100%	1
4DUI_MRD_A_202	98%	59%	0.06	0.982	0.8	0.79	-	-	0	0	100%	1
1SWU_MRD_A_1	97%	67%	0.05	0.967	0.44	0.83	-	1	0	0	100%	1
7EK9_MRD_A_201	97%	88%	0.06	0.977	0.29	0.38	-	-	0	0	100%	1
6B6R_MRD_A_307	97%	70%	0.068	0.985	0.56	0.58	-	-	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.