Table 1.

Summary of input data and output statistics for the case studies. For each target, the corresponding reference PDB entry is given along with the length of the protein sequence and the number of input NOE cross-peaks used. The number of NOE restraints generated by ARIAweb at the last iteration is also shown. Ramachandran statistics, RMS of NOE restraints violations and bundle precision (mean pairwise RMSD) are presented as indicators for the quality of the generated structure ensembles

Target	PDB	Length.	# NOE cross-peaks (input)	# NOE restraints (output)	Ramachandran statistics (%)b	NOE RMS (Å)	Bundle RMSDa (Å)	Bundle Accuracya (Å)
Tudor	1G5V	56	2172	1160	90.0/10.0/0.0/0.0	0.112	0.35 (0.08)	1.01 (0.11)
HRDC	1D8B	91	3155	1698	89.3/8.4/1.3/1.0	0.064	0.44 (0.07)	1.36 (0.12)
CsfB#	5N7Y	2 × 49	1658	2 × 709c	77.8/18.9/0.0/3.3	0.143	0.33 (0.09)	1.12 (0.08)
RBM20	6SO9	112d	6185	2982	86.7/10.1/2.6/0.6	0.142	0.13 (0.02)	1.57 (0.07)
MANEC	2MSX	114	5201	2349	84.0/15.2/0.2/0.6	0.288	0.58 (0.11)	1.41 (0.10)
HypA#	6G81	117	5336	2048	82.0/15.3/1.7/1.0	0.173	0.74 (0.24)	1.96 (0.32)
HR5460A	2LAH	160	17250	4807	88.5/11.2/0.3/0.0	0.175	0.38 (0.06)	1.25 (0.11)

^aMean RMSD (sd) for backbone atoms of well-ordered residues.

^bPercentage of residues of the full-length sequence in the most favored/allowed/generously allowed/disallowed regions of the Ramachandran plot.

^cRestraint list is automatically copied for each chain in symmetric dimer.

^dIn complex with 6 bp RNA.

^#protein containing Zn ion bound in tetrahedral coordination.