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. 2018 Jul 10;293(35):13717–13724. doi: 10.1074/jbc.RA118.003562

Table 4.

Data collection and refinement statistics for zebrafish TRAP1 bound to AMPPNP (Protein Data Bank code 6D14) and calcium

Values in parentheses are for highest-resolution shell.

Zebrafish TRAP1 bound to AMPPNP and calcium
Wavelength 1.116
Resolution range 48.4–2.5 (2.591–2.5)
Space group C 1 2 1
Unit cell 176.252 95.751 124.546 90 134.663 90
Unique reflections 49,471 (4,870)
Completeness (%) 97.6
Mean I/σ(I) 10.36
Wilson B-factor 61.0
Rmeas 11.3%
CC1/2 99.6%
Reflections used in refinement 47,254 (4,868)
Reflections used for Rfree 2,488 (251)
    Rwork 0.230 (0.4170)
    Rfree 0.253 (0.4471)
Number of non-hydrogen atoms 9,794
    Macromolecules 9,553
    Ligands 64
    Solvent 177
Protein residues 1,185
Root mean square (bonds) 0.016
Root mean square (angles) 1.31
Ramachandran favored (%) 93.67
Ramachandran allowed (%) 5.12
Ramachandran outliers (%) 1.21
Rotamer outliers (%) 9.65
Clashscore 11.10
Average B-factor 73.67
    Macromolecules 74.35
    Ligands 42.12
    Solvent 48.43
Number of TLS groups 7