Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "351bb169994c8171ad192bf779ea2a6f",
"space_group_name": "P 32",
"unit_cell": {
"a": 99.459,
"b": 99.459,
"c": 148.426,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97500],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.73,3.500],
"number_observations_unique": 19211,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.160
},
{
"type": "R(meas)",
"value": 0.194
},
{
"type": "R(pim)",
"value": 0.109
},
{
"type": "I/SigI",
"value": 4.500
},
{
"type": "Completeness",
"value": 92.600
},
{
"type": "Redundancy",
"value": 2.600
},
{
"type": "CC(1/2)",
"value": 0.984
}
]
},
"refln_shells": [
{
"resolution_limits": [3.830,3.500],
"number_observations": 11242,
"number_observations_unique": 4396,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.694
},
{
"type": "R(meas)",
"value": 0.849
},
{
"type": "R(pim)",
"value": 0.480
},
{
"type": "I/SigI",
"value": 1.000
},
{
"type": "Completeness",
"value": 88.400
},
{
"type": "Redundancy",
"value": 2.600
},
{
"type": "CC(1/2)",
"value": 0.543
}
]
},
{
"resolution_limits": [49.730,8.570],
"number_observations": 3494,
"number_observations_unique": 1319,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "R(meas)",
"value": 0.051
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 14.300
},
{
"type": "Completeness",
"value": 92.400
},
{
"type": "Redundancy",
"value": 2.600
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
}
]
}