Ligand validation:4AJ1

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
4AJ1_MLI_C_1335	97%	29%	0.063	0.978	0.97	1.99	-	3	0	0	100%	1
4AJ1_MLI_B_1335	96%	23%	0.065	0.975	1.04	2.26	-	4	0	0	100%	1
4AJ1_MLI_C_1334	95%	25%	0.068	0.97	1.8	1.44	1	1	0	0	100%	1
4AJ1_MLI_B_1334	94%	26%	0.081	0.98	1.33	1.83	-	1	0	0	100%	1
4AJ1_MLI_D_1335	94%	23%	0.07	0.967	1.32	1.99	-	3	0	0	100%	1
4AJ1_MLI_A_1334	90%	24%	0.083	0.967	1.44	1.79	-	4	0	0	100%	1
4AJ1_MLI_D_1336	80%	30%	0.127	0.977	1.18	1.73	-	3	0	0	100%	1
4AJ1_MLI_A_1335	66%	31%	0.149	0.955	1.16	1.68	-	2	0	0	100%	1
4AJ2_MLI_B_1334	98%	39%	0.053	0.976	1.07	1.35	-	-	0	0	100%	1
4AJ4_MLI_D_1333	96%	44%	0.067	0.976	1.36	0.86	-	-	0	0	100%	1
4AJJ_MLI_A_1333	93%	50%	0.07	0.963	1.14	0.79	-	-	0	0	100%	1
4AJE_MLI_C_1334	81%	38%	0.108	0.959	1.24	1.27	1	-	0	0	100%	1
2BWD_MLI_A_503	100%	21%	0.046	0.991	2.08	1.38	1	1	0	0	100%	0.8
2BW5_MLI_A_504	99%	11%	0.046	0.984	2.7	1.68	2	2	0	0	100%	1
4AZD_MLI_A_1118	99%	24%	0.054	0.986	1.65	1.59	2	1	0	0	100%	1
4MCO_MLI_B_401	99%	45%	0.053	0.984	1.07	1.08	-	-	0	0	100%	1
3ZVS_MLI_B_1163	99%	42%	0.057	0.987	1.04	1.24	-	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 R01GM133198.