Ligand validation:3TSH

MLI: MALONATE ION

	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
3TSH_MLI_A_605	72%	25%	0.145	0.969	1.94	1.11	2	-	0	0	100%	1
4PWB_MLI_A_604	20%	41%	0.213	0.814	1.13	1.17	-	-	0	0	100%	0.8
4C89_MLI_A_1340	100%	29%	0.036	0.994	1.17	1.66	-	3	1	0	100%	1
2W7A_MLI_B_1253	100%	38%	0.035	0.987	1.1	1.31	-	1	0	0	100%	1
2BWD_MLI_A_503	100%	19%	0.046	0.991	2.08	1.38	1	1	0	0	100%	0.8
2BW5_MLI_A_504	99%	10%	0.046	0.984	2.7	1.68	2	2	0	0	100%	1
4AZD_MLI_A_1118	99%	22%	0.054	0.986	1.65	1.59	2	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.