Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "725e0d989e7946ab8d002a2f1c13eb45",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 63.921,
"b": 107.750,
"c": 69.361,
"alpha": 90.00,
"beta": 104.26,
"gamma": 90.00
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.16,1.400],
"number_observations_unique": 175909,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.090
},
{
"type": "R(meas)",
"value": 0.097
},
{
"type": "R(pim)",
"value": 0.037
},
{
"type": "I/SigI",
"value": 11.200
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.420,1.400],
"number_observations_unique": 8610,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.564
},
{
"type": "R(meas)",
"value": 1.690
},
{
"type": "R(pim)",
"value": 0.637
},
{
"type": "Completeness",
"value": 97.000
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.561
}
]
},
{
"resolution_limits": [47.160,7.670],
"number_observations_unique": 1122,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "R(meas)",
"value": 0.039
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}