Statistic | Data |
---|---|

Crystal | |

Space group | P4_{1}2_{1}2 |

Unit cell constants (Å,°) | a = b = 106.9; c = 88.8; α, β, γ = 90 |

Data set statistics | |

Resolution^{b} (Å) | 30.0-1.80 (1.83-1.80) |

No. of observations | 690,654 (51,453) |

No. of unique reflections | 48,156 (3,528) |

Mosaicity (°) | 0.22 |

Completeness (%) | 99.8 (100.0) |

Multiplicitiy | 14.3 (14.6) |

I/σI | 32.2 (5.3) |

R_{sym} (%) | 4.7 (55.3) |

Refinement statistics | |

R_{cryst} (%) | 21.0 |

R_{free} (%) | 25.2 |

No. of protein atoms | 3,210 |

No. of peptide atoms | 83 |

No. of water molecules | 230 |

Wilson B value | 29.2 |

Avg B value (Å^{2}) | 40.4 |

Light chain | 38.0 |

Heavy chain | 43.0 |

Peptide | 41.7 |

Water | 38.8 |

RMS deviation for bond | |

lengths (Å) | 0.016 |

RMS deviation for bond | |

angles (°) | 1.55 |

Ramachandran plot^{c} (%) | 97.0 (0.0) |

↵

*a**R*_{sym}= Σ|*I*− <_{i}*I*>|/Σ|_{i}*I*|, where_{i}*I*is the scaled intensity of the_{i}*i*th measurement, and <*I*> is the mean intensity for that reflection._{i}*R*_{cryst}= Σ‖*F*_{obs}|−|*F*_{calc}‖/Σ|*F*_{obs}|, where*F*_{calc}and*F*_{obs}are the calculated and observed structure factor amplitudes, respectively.*R*_{free}= as for*R*_{cryst}, but for 5% of the total reflections chosen at random and omitted from refinement. RMS, root mean square.↵

*b*Statistics for the highest resolution shell are in parentheses.↵

*c*Percentage of residues in the favored region of the Ramachandran plot generated by MolProbity (21) (outliers are in parentheses).