Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "81ccdfaa6e1cf5b5cbdb69cf9ec6d499",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 93.302,
"b": 94.120,
"c": 70.734,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97625],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.651,1.927],
"number_observations_unique": 18953,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.115
},
{
"type": "R(meas)",
"value": 0.125
},
{
"type": "R(pim)",
"value": 0.050
},
{
"type": "I/SigI",
"value": 9.800
},
{
"type": "Completeness",
"value": 88.300
},
{
"type": "Redundancy",
"value": 5.300
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.051,1.927],
"number_observations": 4179,
"number_observations_unique": 949,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.116
},
{
"type": "R(meas)",
"value": 1.269
},
{
"type": "R(pim)",
"value": 0.594
},
{
"type": "I/SigI",
"value": 1.500
},
{
"type": "Completeness",
"value": 56.300
},
{
"type": "Redundancy",
"value": 4.400
},
{
"type": "CC(1/2)",
"value": 0.808
}
]
},
{
"resolution_limits": [46.651,5.825],
"number_observations": 5878,
"number_observations_unique": 948,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.126
},
{
"type": "R(meas)",
"value": 0.137
},
{
"type": "R(pim)",
"value": 0.054
},
{
"type": "I/SigI",
"value": 18.800
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.200
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
}
]
}