Ligand validation:2QCU

EDO: 1,2-ETHANEDIOL

	Best-fitted instance in this entry
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	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	Model completeness	Average occupancy
2QCU_EDO_B_814	81%	88%	0.111	0.962	0.51	0.18	-	-	0	100%	1
2QCU_EDO_A_811	79%	76%	0.105	0.951	0.5	0.46	-	-	1	100%	1
2QCU_EDO_A_815	77%	85%	0.089	0.927	0.51	0.24	-	-	1	100%	1
2QCU_EDO_A_808	66%	80%	0.125	0.93	0.41	0.44	-	-	4	100%	1
2QCU_EDO_A_818	65%	63%	0.147	0.95	0.32	1.08	-	-	8	100%	1
2QCU_EDO_B_805	65%	89%	0.122	0.922	0.46	0.18	-	-	2	100%	1
2QCU_EDO_A_817	59%	79%	0.106	0.888	0.51	0.37	-	-	0	100%	1
2QCU_EDO_B_809	59%	75%	0.094	0.874	0.43	0.54	-	-	0	100%	1
2QCU_EDO_B_804	58%	80%	0.118	0.895	0.48	0.36	-	-	1	100%	1
2QCU_EDO_B_813	46%	78%	0.141	0.876	0.42	0.47	-	-	0	100%	1
2QCU_EDO_B_811	40%	71%	0.195	0.907	0.65	0.47	-	-	2	100%	1
2QCU_EDO_B_808	39%	91%	0.234	0.942	0.53	0.06	-	-	1	100%	1
2QCU_EDO_A_816	36%	92%	0.185	0.878	0.47	0.05	-	-	1	100%	1
2QCU_EDO_B_817	36%	58%	0.132	0.821	0.66	0.93	-	-	1	100%	1
2QCU_EDO_A_814	35%	85%	0.159	0.847	0.48	0.27	-	-	3	100%	1
2QCU_EDO_B_820	35%	81%	0.16	0.845	0.43	0.39	-	-	0	100%	1
2QCU_EDO_B_812	34%	87%	0.144	0.824	0.6	0.12	-	-	5	100%	1
2QCU_EDO_A_809	32%	81%	0.226	0.899	0.51	0.31	-	-	2	100%	1
2QCU_EDO_A_812	32%	74%	0.127	0.796	0.46	0.55	-	-	1	100%	1
2QCU_EDO_A_806	31%	70%	0.167	0.835	0.48	0.68	-	-	3	100%	1
2QCU_EDO_B_806	25%	74%	0.171	0.808	0.51	0.49	-	-	0	100%	1
2QCU_EDO_A_810	25%	73%	0.126	0.759	0.44	0.61	-	-	0	100%	1
2QCU_EDO_B_816	25%	78%	0.196	0.828	0.46	0.43	-	-	0	100%	1
2QCU_EDO_B_819	21%	77%	0.143	0.751	0.57	0.36	-	-	0	100%	1
2QCU_EDO_A_822	21%	87%	0.273	0.884	0.51	0.2	-	-	1	100%	1
2QCU_EDO_A_820	20%	88%	0.184	0.788	0.5	0.19	-	-	3	100%	1
2QCU_EDO_B_815	10%	80%	0.147	0.646	0.52	0.33	-	-	0	100%	1
2QCU_EDO_B_807	10%	81%	0.177	0.676	0.52	0.31	-	-	1	100%	1
2QCU_EDO_A_819	7%	84%	0.327	0.779	0.47	0.3	-	-	1	100%	1
2QCU_EDO_A_813	4%	79%	0.209	0.585	0.49	0.37	-	-	0	100%	1
2R45_EDO_A_1962	86%	82%	0.112	0.98	0.76	0.06	-	-	2	100%	1
2R46_EDO_A_7070	78%	76%	0.107	0.949	0.33	0.62	-	-	0	100%	1
2R4E_EDO_A_1958	73%	57%	0.128	0.954	1.11	0.57	-	-	0	100%	1
6ANS_EDO_A_404	100%	89%	0.029	0.995	0.57	0.07	-	-	0	100%	1
4ITB_EDO_A_503	100%	88%	0.028	0.99	0.38	0.29	-	-	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

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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2QCU

EDO: 1,2-ETHANEDIOL