Ligand validation:4ITB

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 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	Model completeness	Average occupancy
4ITB_EDO_A_503	100%	88%	0.028	0.99	0.38	0.29	-	-	0	100%	1
4ITB_EDO_B_503	100%	83%	0.032	0.989	0.44	0.35	-	-	0	100%	1
4ITB_EDO_A_505	97%	84%	0.056	0.972	0.42	0.34	-	-	0	100%	1
4ITB_EDO_B_506	92%	84%	0.069	0.959	0.44	0.32	-	-	0	100%	1
4ITB_EDO_B_504	82%	75%	0.097	0.951	0.31	0.66	-	-	0	100%	1
4ITB_EDO_B_505	71%	78%	0.112	0.933	0.42	0.46	-	-	0	100%	1
4ITB_EDO_A_506	67%	78%	0.122	0.929	0.49	0.41	-	-	0	100%	1
4ITB_EDO_A_515	55%	91%	0.138	0.906	0.45	0.13	-	-	0	100%	1
4ITB_EDO_B_507	53%	83%	0.154	0.915	0.41	0.37	-	-	0	100%	1
4ITB_EDO_A_511	49%	81%	0.136	0.883	0.42	0.4	-	-	0	100%	1
4ITB_EDO_B_512	46%	80%	0.131	0.865	0.45	0.39	-	-	0	100%	1
4ITB_EDO_A_507	45%	87%	0.128	0.858	0.48	0.23	-	-	0	100%	1
4ITB_EDO_A_514	42%	83%	0.186	0.904	0.41	0.38	-	-	0	100%	1
4ITB_EDO_A_504	39%	72%	0.18	0.888	0.44	0.62	-	-	2	100%	1
4ITB_EDO_B_508	31%	75%	0.21	0.877	0.41	0.55	-	-	1	100%	1
4ITB_EDO_A_508	29%	88%	0.158	0.815	0.45	0.23	-	-	0	100%	1
4ITB_EDO_A_512	28%	81%	0.148	0.801	0.45	0.38	-	-	0	100%	1
4ITB_EDO_B_510	24%	75%	0.193	0.824	0.43	0.54	-	-	1	100%	1
4ITB_EDO_A_513	24%	80%	0.218	0.846	0.27	0.56	-	-	4	100%	1
4ITB_EDO_B_513	14%	85%	0.251	0.806	0.25	0.49	-	-	2	100%	1
4ITB_EDO_B_509	13%	84%	0.225	0.764	0.46	0.31	-	-	4	100%	1
4ITB_EDO_B_511	13%	82%	0.158	0.692	0.48	0.32	-	-	0	100%	1
4ITB_EDO_A_510	12%	76%	0.265	0.796	0.45	0.5	-	-	0	100%	1
4ITB_EDO_A_509	6%	83%	0.212	0.648	0.49	0.29	-	-	0	100%	1
6ANS_EDO_A_404	100%	89%	0.029	0.995	0.57	0.07	-	-	0	100%	1
4FQI_EDO_A_401	100%	85%	0.032	0.992	0.46	0.29	-	-	0	100%	1
4KXW_EDO_A_1003	100%	73%	0.033	0.993	0.64	0.4	-	-	0	100%	1
8JK3_EDO_A_304	100%	81%	0.033	0.992	0.22	0.58	-	-	0	100%	1
3G7R_EDO_B_961	100%	85%	0.035	0.988	0.45	0.3	-	-	1	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.

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4ITB

EDO: 1,2-ETHANEDIOL