Ligand validation:5KQK

MPD: (4S)-2-METHYL-2,4-PENTANEDIOL

	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
5KQK_MPD_A_805	59%	52%	0.118	0.899	0.74	1.09	-	1	5	0	100%	1
5KQK_MPD_A_806	50%	47%	0.156	0.906	0.71	1.33	-	1	0	0	100%	1
5KQK_MPD_B_805	48%	37%	0.153	0.895	1.09	1.37	-	1	9	0	100%	1
5KQK_MPD_B_806	39%	44%	0.159	0.864	0.72	1.41	-	1	6	0	100%	1
6CEK_MPD_A_806	79%	82%	0.102	0.947	0.4	0.4	-	-	4	0	100%	1
5SYJ_MPD_B_805	79%	33%	0.108	0.953	0.84	1.8	-	3	0	0	100%	1
5L05_MPD_B_804	78%	26%	0.089	0.931	0.88	2.06	1	3	0	0	100%	1
6CDQ_MPD_B_806	78%	71%	0.101	0.942	0.35	0.77	-	-	0	0	100%	1
5SX3_MPD_B_805	75%	41%	0.109	0.942	0.42	1.82	-	3	4	0	100%	1
9D77_MPD_A_505	100%	87%	0.032	0.998	0.16	0.52	-	-	1	0	100%	1
9H8Q_MPD_B_602	100%	82%	0.039	0.988	0.35	0.44	-	-	3	0	100%	1
7Z6B_MPD_B_307	99%	74%	0.057	0.986	0.42	0.59	-	-	0	0	100%	1
7ZOB_MPD_F_202	99%	72%	0.056	0.983	0.44	0.65	-	-	0	0	100%	1
4H15_MPD_B_313	97%	89%	0.061	0.974	0.33	0.31	-	-	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.