Ligand validation:3B44

BNG: nonyl beta-D-glucopyranoside

BNG is a Ligand Of Interest in 3B44 designated by the RCSB

	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
3B44_BNG_A_501	40%	73%	0.146	0.855	0.39	0.64	-	-	0	100%	1
3B44_BNG_A_514	35%	87%	0.097	0.921	0.24	0.46	-	-	1	24%	0.2381
3B44_BNG_A_504	28%	87%	0.146	0.908	0.21	0.48	-	-	5	38%	0.381
3B44_BNG_A_515	19%	76%	0.152	0.859	0.4	0.55	-	-	1	38%	0.381
3B44_BNG_A_513	16%	77%	0.153	0.833	0.19	0.72	-	-	0	38%	0.381
3B44_BNG_A_502	15%	74%	0.184	0.745	0.34	0.67	-	-	0	100%	1
3B44_BNG_A_507	15%	73%	0.215	0.828	0.4	0.64	-	1	0	71%	0.7143
3B44_BNG_A_510	12%	82%	0.192	0.826	0.19	0.59	-	-	0	43%	0.4286
3B44_BNG_A_517	11%	88%	0.244	0.902	0.19	0.48	-	-	0	24%	0.2381
3B44_BNG_A_506	11%	88%	0.183	0.821	0.17	0.49	-	-	2	33%	0.3333
3B44_BNG_A_512	10%	87%	0.188	0.808	0.16	0.52	-	-	5	38%	0.381
3B44_BNG_A_503	5%	86%	0.195	0.705	0.19	0.51	-	-	2	38%	0.381
3B44_BNG_A_516	5%	86%	0.228	0.745	0.18	0.52	-	-	0	33%	0.3333
3B44_BNG_A_508	3%	78%	0.252	0.702	0.17	0.71	-	-	2	43%	0.4286
3B44_BNG_A_505	3%	79%	0.218	0.633	0.17	0.69	-	-	2	43%	0.4286
3B44_BNG_A_511	2%	88%	0.211	0.618	0.19	0.46	-	-	0	29%	0.2857
3B44_BNG_A_509	1%	64%	0.299	0.473	0.38	1	-	2	1	100%	1
2XTU_BNG_A_514	46%	72%	0.107	0.901	0.25	0.81	-	-	4	67%	0.6667
3B45_BNG_A_501	31%	73%	0.15	0.818	0.38	0.65	-	-	0	100%	1
3ZOT_BNG_A_407	30%	84%	0.132	0.924	0.27	0.48	-	-	0	29%	0.2857
2XOV_BNG_A_508	30%	89%	0.121	0.911	0.22	0.41	-	-	0	29%	0.2857
2IC8_BNG_A_502	18%	70%	0.195	0.784	0.42	0.73	-	1	2	100%	1
4RP9_BNG_A_503	84%	70%	0.091	0.952	0.38	0.76	-	-	3	100%	1
4DVE_BNG_B_202	81%	66%	0.092	0.945	0.47	0.83	-	1	0	100%	0.5
5B0W_BNG_F_304	74%	49%	0.088	0.917	1.25	0.73	3	-	2	100%	1
4MES_BNG_B_201	72%	51%	0.128	0.953	0.83	1.05	-	2	5	100%	1
4MUU_BNG_A_202	70%	41%	0.117	0.934	0.85	1.45	-	6	1	100%	0.66

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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3B44

BNG: nonyl beta-D-glucopyranoside

BNG is a Ligand Of Interest in 3B44 designated by the RCSB