Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6560d44aff5899111b657dc442102568",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 112.038,
"b": 52.733,
"c": 44.717,
"alpha": 90.00,
"beta": 103.02,
"gamma": 90.00
},
"wavelengths": [0.91260],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [54.560,1.760],
"number_observations": 89917,
"number_observations_unique": 25253,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.194
},
{
"type": "R(meas)",
"value": 0.227
},
{
"type": "R(pim)",
"value": 0.116
},
{
"type": "I/SigI",
"value": 4.700
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
"value": 0.987
}
]
},
"refln_shells": [
{
"resolution_limits": [1.790,1.760],
"number_observations": 4349,
"number_observations_unique": 1381,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.626
},
{
"type": "R(meas)",
"value": 1.947
},
{
"type": "R(pim)",
"value": 1.055
},
{
"type": "I/SigI",
"value": 1.200
},
{
"type": "Completeness",
"value": 96.800
},
{
"type": "Redundancy",
"value": 3.100
},
{
"type": "CC(1/2)",
"value": 0.322
}
]
},
{
"resolution_limits": [54.560,8.970],
"number_observations": 758,
"number_observations_unique": 210,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.090
},
{
"type": "R(meas)",
"value": 0.105
},
{
"type": "R(pim)",
"value": 0.054
},
{
"type": "I/SigI",
"value": 13.300
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
"value": 0.987
}
]
}
]
}