Ligand validation:3IUB

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
3IUB_EDO_A_694	92%	75%	0.056	0.946	0.42	0.57	-	-	0	0	100%	1
3IUB_EDO_A_692	84%	70%	0.089	0.951	0.46	0.69	-	-	0	0	100%	1
3IUB_EDO_B_697	78%	69%	0.097	0.939	0.34	0.83	-	-	0	0	100%	1
3IUB_EDO_A_693	75%	85%	0.097	0.929	0.47	0.28	-	-	0	0	100%	1
3IUB_EDO_B_690	72%	73%	0.132	0.956	0.34	0.7	-	-	0	0	100%	1
3IUB_EDO_B_702	55%	76%	0.15	0.92	0.46	0.49	-	-	0	0	100%	1
3IUB_EDO_A_696	45%	78%	0.142	0.871	0.43	0.45	-	-	0	0	100%	1
3IUB_EDO_B_699	44%	75%	0.145	0.872	0.54	0.44	-	-	0	0	100%	1
3IUB_EDO_B_700	36%	84%	0.179	0.871	0.47	0.3	-	-	0	0	100%	1
3IUB_EDO_A_698	21%	81%	0.214	0.82	0.46	0.36	-	-	2	0	100%	1
3IUB_EDO_B_701	17%	77%	0.239	0.82	0.43	0.49	-	-	0	0	100%	1
3IUB_EDO_B_695	3%	82%	0.277	0.61	0.44	0.37	-	-	1	0	100%	1
4FZJ_EDO_B_404	91%	65%	0.093	0.98	0.36	0.98	-	-	0	0	100%	1
6ANS_EDO_A_404	100%	89%	0.029	0.995	0.57	0.07	-	-	0	0	100%	1
4ITB_EDO_A_503	100%	88%	0.028	0.99	0.38	0.29	-	-	0	0	100%	1
4FQI_EDO_A_401	100%	85%	0.032	0.992	0.46	0.29	-	-	0	0	100%	1
4KXW_EDO_A_1003	100%	73%	0.033	0.993	0.64	0.4	-	-	0	0	100%	1
8JK3_EDO_A_304	100%	81%	0.033	0.992	0.22	0.58	-	-	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.