Ligand validation:3UPK

EDO: 1,2-ETHANEDIOL

	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
3UPK_EDO_A_422	88%	85%	0.091	0.966	0.49	0.26	-	-	0	0	100%	1
3UPK_EDO_A_424	56%	82%	0.106	0.875	0.46	0.34	-	-	1	0	100%	1
3UPK_EDO_A_421	24%	74%	0.198	0.828	0.88	0.14	-	-	2	0	100%	1
3UPK_EDO_A_425	23%	82%	0.199	0.822	0.56	0.25	-	-	0	0	100%	1
3UPK_EDO_A_426	10%	87%	0.285	0.787	0.55	0.15	-	-	3	0	100%	1
3UPK_EDO_A_423	1%	85%	0.483	0.641	0.52	0.24	-	-	0	0	100%	1
3V4T_EDO_A_508	82%	82%	0.106	0.961	0.5	0.3	-	-	0	0	100%	1
3SWA_EDO_A_421	81%	81%	0.093	0.946	0.51	0.31	-	-	0	0	100%	1
3V5V_EDO_B_508	79%	84%	0.13	0.975	0.52	0.25	-	-	4	0	100%	1
4E7D_EDO_D_505	78%	77%	0.1	0.943	0.58	0.34	-	-	0	0	100%	1
3SWQ_EDO_A_422	76%	83%	0.111	0.946	0.57	0.22	-	-	0	0	100%	1
2G8S_EDO_A_3016	100%	84%	0.02	0.992	0.42	0.35	-	-	0	0	100%	0.5
3DPJ_EDO_B_195	100%	82%	0.022	0.994	0.47	0.34	-	-	1	0	100%	1
4EYG_EDO_A_402	100%	81%	0.024	0.995	0.44	0.39	-	-	0	0	100%	1
4NMU_EDO_D_206	100%	92%	0.025	0.997	0.38	0.14	-	-	0	0	100%	1
4Q6J_EDO_A_302	100%	82%	0.013	0.999	0.37	0.42	-	-	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.