Ligand validation:8H8S

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	Model completeness	Average occupancy
8H8S_EDO_F_103	92%	90%	0.103	0.994	0.26	0.36	-	-	1	100%	0.5
8H8S_EDO_S_103	85%	96%	0.121	0.988	0.2	0.17	-	-	0	100%	0.5
8H8S_EDO_B_305	85%	89%	0.121	0.986	0.21	0.43	-	-	0	100%	0.5
8H8S_EDO_A_613	83%	90%	0.113	0.973	0.38	0.22	-	-	0	100%	0.5
8H8S_EDO_C_322	82%	100%	0.095	0.951	0.13	0.06	-	-	2	100%	0.5
8H8S_EDO_T_106	81%	97%	0.118	0.971	0.08	0.22	-	-	0	100%	0.5
8H8S_EDO_S_102	75%	91%	0.145	0.979	0.34	0.23	-	-	1	100%	0.5
8H8S_EDO_P_320	74%	92%	0.141	0.973	0.33	0.19	-	-	0	100%	0.5
8H8S_EDO_R_203	70%	78%	0.146	0.965	0.36	0.54	-	-	0	100%	0.5
8H8S_EDO_N_610	69%	94%	0.134	0.948	0.35	0.08	-	-	1	100%	0.5
8H8S_EDO_N_611	69%	90%	0.116	0.929	0.25	0.35	-	-	0	100%	0.5
8H8S_EDO_O_309	66%	93%	0.14	0.944	0.22	0.27	-	-	0	100%	0.5
8H8S_EDO_N_613	64%	95%	0.174	0.975	0.19	0.21	-	-	0	100%	0.5
8H8S_EDO_F_102	62%	87%	0.162	0.955	0.49	0.22	-	-	0	100%	0.5
8H8S_EDO_G_104	61%	95%	0.15	0.939	0.26	0.15	-	-	0	100%	0.5
8H8S_EDO_R_202	57%	91%	0.156	0.931	0.42	0.16	-	-	0	100%	0.5
8H8S_EDO_A_612	56%	75%	0.196	0.97	0.72	0.26	-	-	0	100%	0.5
8H8S_EDO_E_203	53%	93%	0.203	0.964	0.23	0.25	-	-	0	100%	0.5
8H8S_EDO_N_612	52%	91%	0.203	0.963	0.44	0.14	-	-	0	100%	0.5
8H8S_EDO_E_202	50%	93%	0.189	0.941	0.23	0.24	-	-	0	100%	0.5
8H8S_EDO_R_201	48%	86%	0.196	0.94	0.28	0.44	-	-	0	100%	0.5
8H8S_EDO_A_611	44%	90%	0.187	0.916	0.19	0.41	-	-	0	100%	0.5
8H8S_EDO_A_610	42%	79%	0.166	0.883	0.57	0.31	-	-	0	100%	0.5
8H8S_EDO_P_319	40%	98%	0.214	0.927	0.26	0.04	-	-	1	100%	0.5
8H8S_EDO_C_323	36%	55%	0.228	0.921	0.85	0.89	-	-	0	100%	0.5
8H8S_EDO_P_321	30%	58%	0.231	0.895	0.54	1.06	-	-	0	100%	0.5
8H8S_EDO_C_321	19%	98%	0.336	0.936	0.04	0.21	-	-	0	100%	0.5
8H8S_EDO_E_201	15%	77%	0.246	0.809	0.37	0.54	-	-	0	100%	0.5
8H8S_EDO_N_614	11%	44%	0.325	0.85	0.65	1.48	-	-	3	100%	0.5
5B1B_EDO_B_303	100%	77%	0.04	0.984	0.57	0.35	-	-	0	100%	1
3AG2_EDO_F_102	100%	66%	0.046	0.989	0.9	0.43	-	-	0	100%	1
7YPY_EDO_S_106	100%	84%	0.044	0.985	0.7	0.08	-	-	0	100%	1
5ZCQ_EDO_E_203	98%	62%	0.057	0.983	0.5	0.93	-	-	0	100%	1
7VVR_EDO_F_102	98%	56%	0.063	0.989	1.04	0.66	-	-	0	100%	1
2G8S_EDO_A_3016	100%	84%	0.02	0.992	0.42	0.35	-	-	0	100%	0.5
3DPJ_EDO_B_195	100%	82%	0.022	0.994	0.47	0.34	-	-	1	100%	1
4EYG_EDO_A_402	100%	81%	0.024	0.995	0.44	0.39	-	-	0	100%	1
4NMU_EDO_D_206	100%	92%	0.025	0.997	0.38	0.14	-	-	0	100%	1
4Q6J_EDO_A_302	100%	82%	0.013	0.999	0.37	0.42	-	-	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.

Prepare Data

Validate Data

Deposit Data

Help and Resources

8H8S

EDO: 1,2-ETHANEDIOL