Ligand validation:4XN5

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
4XN5_MLI_A_910	65%	37%	0.141	0.944	1.21	1.26	-	-	1	0	100%	1
4XN5_MLI_A_911	60%	16%	0.174	0.96	1.19	2.45	-	3	1	0	100%	1
4XN5_MLI_A_914	48%	23%	0.191	0.935	1.07	2.07	-	2	1	0	100%	0.8
4XN5_MLI_A_913	42%	45%	0.229	0.949	1.27	0.86	1	-	0	0	100%	1
4XN5_MLI_A_915	28%	15%	0.197	0.849	2.06	1.69	2	2	0	0	100%	1
4XN5_MLI_A_912	24%	18%	0.233	0.861	1.75	1.79	2	1	0	0	100%	1
4XN5_MLI_A_916	2%	37%	0.484	0.766	1.58	0.9	1	-	1	0	100%	1
3B2X_MLI_A_990	97%	44%	0.061	0.976	1.11	1.04	-	-	1	0	100%	0.5
5MFT_MLI_A_1022	82%	42%	0.12	0.976	1.12	1.12	-	-	0	0	100%	0.56
5MFS_MLI_A_1015	77%	50%	0.133	0.972	1.07	0.86	-	-	0	0	100%	0.5
4XND_MLI_A_939	72%	49%	0.133	0.957	1.14	0.82	-	-	0	0	100%	0.6
5YQ2_MLI_A_905	68%	24%	0.101	0.91	1.46	1.63	-	2	0	0	100%	0.6
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.