Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "53e30e35f7264ee4183c37d0d4cffb16",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 54.887,
"b": 90.914,
"c": 74.872,
"alpha": 90.000,
"beta": 110.131,
"gamma": 90.000
},
"wavelengths": [0.97930],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [27.81,1.47],
"number_observations_unique": 57386,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.112
},
{
"type": "R(meas)",
"value": 0.124
},
{
"type": "R(pim)",
"value": 0.054
},
{
"type": "I/SigI",
"value": 9.0
},
{
"type": "Completeness",
"value": 98.9
},
{
"type": "Redundancy",
"value": 5.1
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.51,1.47],
"number_observations_unique": 3661,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.742
},
{
"type": "R(meas)",
"value": 0.831
},
{
"type": "R(pim)",
"value": 0.368
},
{
"type": "I/SigI",
"value": 1.7
},
{
"type": "Completeness",
"value": 85.5
},
{
"type": "Redundancy",
"value": 4.8
},
{
"type": "CC(1/2)",
"value": 0.711
}
]
}
]
}