Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "200769ace87febfbd724605f851c8c74",
"space_group_name": "I 41 3 2",
"unit_cell": {
"a": 225.766,
"b": 225.766,
"c": 225.766,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.03320],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.00,2.06],
"number_observations_unique": 58699,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.162
},
{
"type": "R(meas)",
"value": 0.165
},
{
"type": "R(pim)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 6.1
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 31.1
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [2.15,2.08],
"number_observations_unique": 5769,
"quality_factors": [
{
"type": "R(merge)",
"value": 4.236
},
{
"type": "R(meas)",
"value": 4.323
},
{
"type": "R(pim)",
"value": 0.859
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 25.1
},
{
"type": "CC(1/2)",
"value": 0.301
}
]
},
{
"resolution_limits": [2.24,2.15],
"number_observations_unique": 5789,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.759
},
{
"type": "R(meas)",
"value": 2.810
},
{
"type": "R(pim)",
"value": 0.530
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 27.9
},
{
"type": "CC(1/2)",
"value": 0.707
}
]
},
{
"resolution_limits": [2.34,2.24],
"number_observations_unique": 5782,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.648
},
{
"type": "R(meas)",
"value": 1.675
},
{
"type": "R(pim)",
"value": 0.300
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 30.6
},
{
"type": "CC(1/2)",
"value": 0.857
}
]
},
{
"resolution_limits": [2.47,2.34],
"number_observations_unique": 5819,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.038
},
{
"type": "R(meas)",
"value": 1.054
},
{
"type": "R(pim)",
"value": 0.179
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 34.3
},
{
"type": "CC(1/2)",
"value": 0.939
}
]
},
{
"resolution_limits": [2.62,2.47],
"number_observations_unique": 5825,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.677
},
{
"type": "R(meas)",
"value": 0.687
},
{
"type": "R(pim)",
"value": 0.118
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 33.8
},
{
"type": "CC(1/2)",
"value": 0.972
}
]
},
{
"resolution_limits": [2.82,2.62],
"number_observations_unique": 5828,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.426
},
{
"type": "R(meas)",
"value": 0.433
},
{
"type": "R(pim)",
"value": 0.075
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 32.9
},
{
"type": "CC(1/2)",
"value": 0.988
}
]
},
{
"resolution_limits": [3.11,2.82],
"number_observations_unique": 5856,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.253
},
{
"type": "R(meas)",
"value": 0.257
},
{
"type": "R(pim)",
"value": 0.045
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 31.7
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
{
"resolution_limits": [3.56,3.11],
"number_observations_unique": 5897,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.146
},
{
"type": "R(meas)",
"value": 0.149
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 30.9
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [4.48,3.56],
"number_observations_unique": 5928,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.101
},
{
"type": "R(meas)",
"value": 0.102
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 33.1
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [50.00,4.48],
"number_observations_unique": 6206,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.071
},
{
"type": "R(meas)",
"value": 0.073
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 30.5
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}