Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "283702702284d59fedd3bf676facd52d",
"space_group_name": "P 1",
"unit_cell": {
"a": 37.013,
"b": 40.198,
"c": 105.158,
"alpha": 84.50,
"beta": 85.48,
"gamma": 62.71
},
"wavelengths": [0.97949],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [35.640,2.000],
"number_observations": 66586,
"number_observations_unique": 34483,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.040
},
{
"type": "R(meas)",
"value": 0.054
},
{
"type": "R(pim)",
"value": 0.037
},
{
"type": "I/SigI",
"value": 10.000
},
{
"type": "Completeness",
"value": 94.800
},
{
"type": "Redundancy",
"value": 1.900
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.050,2.000],
"number_observations": 3666,
"number_observations_unique": 2199,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.760
},
{
"type": "R(meas)",
"value": 1.032
},
{
"type": "R(pim)",
"value": 0.694
},
{
"type": "I/SigI",
"value": 0.900
},
{
"type": "Completeness",
"value": 81.400
},
{
"type": "Redundancy",
"value": 1.700
},
{
"type": "CC(1/2)",
"value": 0.465
}
]
},
{
"resolution_limits": [35.640,8.930],
"number_observations": 769,
"number_observations_unique": 396,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.024
},
{
"type": "R(meas)",
"value": 0.031
},
{
"type": "R(pim)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 31.300
},
{
"type": "Completeness",
"value": 96.600
},
{
"type": "Redundancy",
"value": 1.900
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}