Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "42234dca426d6153c1e595881386b8c9",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 57.750,
"b": 93.410,
"c": 94.215,
"alpha": 90.00,
"beta": 107.83,
"gamma": 90.00
},
"wavelengths": [0.92819],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.380,1.470],
"number_observations": 540576,
"number_observations_unique": 157969,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "R(meas)",
"value": 0.042
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 17.200
},
{
"type": "Completeness",
"value": 98.000
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.510,1.470],
"number_observations": 36278,
"number_observations_unique": 11294,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.003
},
{
"type": "R(meas)",
"value": 1.202
},
{
"type": "R(pim)",
"value": 0.653
},
{
"type": "I/SigI",
"value": 1.300
},
{
"type": "Completeness",
"value": 95.500
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.520
}
]
},
{
"resolution_limits": [47.380,6.570],
"number_observations": 6755,
"number_observations_unique": 1852,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.018
},
{
"type": "R(meas)",
"value": 0.021
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 73.200
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}