Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7dd2d1cddcab8ac46605bb1c2c760879",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 62.262,
"b": 69.258,
"c": 64.106,
"alpha": 90.00,
"beta": 102.38,
"gamma": 90.00
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [69.26,2.06],
"number_observations_unique": 33086,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.170
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 19.4
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 45.99
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [2.10,2.06],
"number_observations_unique": 1647,
"quality_factors": [
{
"type": "R(meas)",
"value": 4.606
},
{
"type": "R(pim)",
"value": 0.726
},
{
"type": "I/SigI",
"value": 0.4
},
{
"type": "Completeness",
"value": 100
},
{
"type": "CC(1/2)",
"value": 0.603
}
]
},
{
"resolution_limits": [2.13,2.10],
"number_observations_unique": 1646,
"quality_factors": [
{
"type": "R(meas)",
"value": 8.076
},
{
"type": "R(pim)",
"value": 1.232
},
{
"type": "I/SigI",
"value": 0.5
},
{
"type": "Completeness",
"value": 100
},
{
"type": "CC(1/2)",
"value": 0.752
}
]
},
{
"resolution_limits": [2.17,2.13],
"number_observations_unique": 1606,
"quality_factors": [
{
"type": "R(meas)",
"value": 6.294
},
{
"type": "R(pim)",
"value": 0.943
},
{
"type": "I/SigI",
"value": 0.6
},
{
"type": "Completeness",
"value": 100
},
{
"type": "CC(1/2)",
"value": 0.856
}
]
},
{
"resolution_limits": [2.22,2.17],
"number_observations_unique": 1666,
"quality_factors": [
{
"type": "R(meas)",
"value": 4.701
},
{
"type": "R(pim)",
"value": 0.694
},
{
"type": "I/SigI",
"value": 0.8
},
{
"type": "Completeness",
"value": 100
},
{
"type": "CC(1/2)",
"value": 0.930
}
]
},
{
"resolution_limits": [2.27,2.22],
"number_observations_unique": 1652,
"quality_factors": [
{
"type": "R(meas)",
"value": 3.137
},
{
"type": "R(pim)",
"value": 0.458
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Completeness",
"value": 100
},
{
"type": "CC(1/2)",
"value": 0.908
}
]
},
{
"resolution_limits": [2.32,2.27],
"number_observations_unique": 1644,
"quality_factors": [
{
"type": "R(meas)",
"value": 3.407
},
{
"type": "R(pim)",
"value": 0.495
},
{
"type": "I/SigI",
"value": 1.2
},
{
"type": "Completeness",
"value": 100
},
{
"type": "CC(1/2)",
"value": 0.923
}
]
},
{
"resolution_limits": [2.38,2.32],
"number_observations_unique": 1647,
"quality_factors": [
{
"type": "R(meas)",
"value": 2.638
},
{
"type": "R(pim)",
"value": 0.385
},
{
"type": "I/SigI",
"value": 1.4
},
{
"type": "Completeness",
"value": 100
},
{
"type": "CC(1/2)",
"value": 0.960
}
]
},
{
"resolution_limits": [2.44,2.38],
"number_observations_unique": 1635,
"quality_factors": [
{
"type": "R(meas)",
"value": 2.056
},
{
"type": "R(pim)",
"value": 0.304
},
{
"type": "I/SigI",
"value": 1.8
},
{
"type": "Completeness",
"value": 100
},
{
"type": "CC(1/2)",
"value": 0.963
}
]
},
{
"resolution_limits": [2.51,2.44],
"number_observations_unique": 1646,
"quality_factors": [
{
"type": "R(meas)",
"value": 1.552
},
{
"type": "R(pim)",
"value": 0.229
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Completeness",
"value": 100
},
{
"type": "CC(1/2)",
"value": 0.981
}
]
},
{
"resolution_limits": [2.60,2.51],
"number_observations_unique": 1650,
"quality_factors": [
{
"type": "R(meas)",
"value": 1.081
},
{
"type": "R(pim)",
"value": 0.160
},
{
"type": "I/SigI",
"value": 3.2
},
{
"type": "Completeness",
"value": 100
},
{
"type": "CC(1/2)",
"value": 0.987
}
]
},
{
"resolution_limits": [2.69,2.60],
"number_observations_unique": 1659,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.923
},
{
"type": "R(pim)",
"value": 0.134
},
{
"type": "I/SigI",
"value": 3.8
},
{
"type": "Completeness",
"value": 100
},
{
"type": "CC(1/2)",
"value": 0.88
}
]
},
{
"resolution_limits": [2.80,2.69],
"number_observations_unique": 1644,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.968
},
{
"type": "R(pim)",
"value": 0.101
},
{
"type": "I/SigI",
"value": 5.1
},
{
"type": "Completeness",
"value": 100
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
{
"resolution_limits": [2.92,2.80],
"number_observations_unique": 1659,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.478
},
{
"type": "R(pim)",
"value": 0.069
},
{
"type": "I/SigI",
"value": 7.5
},
{
"type": "Completeness",
"value": 100
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
{
"resolution_limits": [3.08,2.92],
"number_observations_unique": 1639,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.310
},
{
"type": "R(pim)",
"value": 0.045
},
{
"type": "I/SigI",
"value": 11.8
},
{
"type": "Completeness",
"value": 100
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [3.27,3.08],
"number_observations_unique": 1661,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.219
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 16.9
},
{
"type": "Completeness",
"value": 100
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [3.52,3.27],
"number_observations_unique": 1655,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.155
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 27.0
},
{
"type": "Completeness",
"value": 100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [3.88,3.52],
"number_observations_unique": 1671,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.112
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 43.3
},
{
"type": "Completeness",
"value": 100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [4.44,3.88],
"number_observations_unique": 1663,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.091
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 63.9
},
{
"type": "Completeness",
"value": 100
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
{
"resolution_limits": [5.59,4.44],
"number_observations_unique": 1671,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.076
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 82.4
},
{
"type": "Completeness",
"value": 100
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
{
"resolution_limits": [69.30,5.59],
"number_observations_unique": 1725,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.068
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 106.9
},
{
"type": "Completeness",
"value": 100
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}