Ligand validation:4JI9

1M3: N-tert-butyl-3-[(5-methyl-2-{[4-(4-methylpiperazin-1-yl)phenyl]amino}pyrimidin-4-yl)amino]benzenesulfonamide

1M3 is a Ligand Of Interest in 4JI9 designated by the RCSB

	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
4JI9_1M3_A_1201	65%	21%	0.139	0.941	1.75	1.58	2	12	2	0	100%	1
4JI9_1M3_B_1201	62%	23%	0.143	0.934	1.78	1.38	3	9	2	0	100%	1
5HEZ_1M3_B_1203	62%	20%	0.185	0.977	1.18	2.18	3	14	0	0	100%	1
4O76_1M3_A_201	97%	4%	0.071	0.983	3.33	2.47	4	19	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.