Ligand validation:4IRE

PC1: 1,2-DIACYL-SN-GLYCERO-3-PHOSPHOCHOLINE

PC1 is a Ligand Of Interest in 4IRE 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
4IRE_PC1_B_402	4%	43%	0.436	0.858	1.16	1.08	6	5	0	0	70%	0.7037
4IRE_PC1_A_403	3%	38%	0.443	0.809	1.19	1.31	6	7	2	0	72%	0.7222
4IRE_PC1_D_503	2%	42%	0.383	0.75	1.21	1.08	6	3	1	0	69%	0.6852
4IRE_PC1_B_401	2%	42%	0.421	0.764	1.15	1.16	7	4	2	0	72%	0.7222
4IRE_PC1_C_403	2%	41%	0.444	0.747	1.15	1.18	7	4	0	0	70%	0.7037
4IRE_PC1_E_405	2%	43%	0.426	0.723	1.16	1.11	7	4	1	0	70%	0.7037
4IRE_PC1_D_502	1%	41%	0.448	0.74	1.14	1.22	7	2	3	0	69%	0.6852
4IRE_PC1_E_406	1%	41%	0.547	0.76	1.16	1.21	7	5	0	0	70%	0.7037
4IRE_PC1_A_402	1%	41%	0.552	0.724	1.21	1.16	7	3	0	0	69%	0.6852
4IRE_PC1_C_404	1%	37%	0.511	0.666	1.24	1.33	6	2	0	0	59%	0.5926
3EAM_PC1_E_601	25%	26%	0.202	0.863	1.43	1.69	4	6	0	1	87%	0.8704
5IUX_PC1_B_603	8%	39%	0.259	0.79	1.31	1.16	6	2	0	0	72%	0.7222
4F8H_PC1_A_403	8%	43%	0.323	0.861	1.16	1.1	6	4	0	0	69%	0.6852
2Z73_PC1_B_1004	29%	36%	0.182	0.889	1.64	0.97	2	1	1	0	72%	0.7222
3WGV_PC1_D_3003	28%	46%	0.226	0.878	0.9	1.2	4	4	1	0	100%	1
1BP1_PC1_A_777	22%	52%	0.246	0.864	1.06	0.79	2	2	10	0	100%	1
8JBK_PC1_A_1111	16%	59%	0.321	0.891	0.7	0.86	-	1	8	0	100%	1
5SYT_PC1_A_503	14%	32%	0.184	0.81	1.27	1.54	2	5	4	0	57%	0.5741

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.