Ligand validation:3AG1

HEA: HEME-A

HEA is a Ligand Of Interest in 3AG1 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
3AG1_HEA_A_515	87%	11%	0.118	0.99	1.67	2.51	11	20	1	0	100%	1
3AG1_HEA_N_515	81%	16%	0.125	0.978	1.69	2	15	19	2	0	100%	1
3AG1_HEA_N_516	81%	13%	0.135	0.988	1.68	2.28	12	20	0	0	100%	1
3AG1_HEA_A_516	80%	12%	0.14	0.99	1.61	2.42	11	23	0	0	100%	1
5X1B_HEA_A_602	99%	21%	0.063	0.991	1.66	1.67	12	12	4	0	100%	1
5B1A_HEA_A_602	98%	14%	0.068	0.992	1.74	2.14	12	17	0	0	100%	1
5B1B_HEA_A_602	98%	14%	0.064	0.986	1.61	2.24	9	25	5	0	100%	1
7COH_HEA_N_516	98%	6%	0.07	0.991	1.86	3.28	11	24	0	0	100%	1
5X1F_HEA_A_602	97%	15%	0.074	0.991	1.74	2.04	11	17	0	0	100%	1
2GSM_HEA_A_2001	100%	33%	0.044	0.99	1.45	1.19	6	6	0	0	100%	1
3OMI_HEA_A_607	99%	26%	0.052	0.988	1.34	1.65	6	15	1	0	100%	1
3DTU_HEA_C_575	99%	26%	0.053	0.986	1.41	1.6	7	13	3	0	100%	1
3FYI_HEA_A_567	99%	34%	0.054	0.987	1.47	1.16	7	7	1	0	100%	1
3OMN_HEA_A_1	99%	25%	0.057	0.986	1.35	1.68	5	17	2	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.