Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "4e0202a0769db97c495141f77b7f45be",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 102.342,
"b": 158.093,
"c": 69.274,
"alpha": 90.000,
"beta": 124.593,
"gamma": 90.000
},
"wavelengths": [0.72931],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [79.05,1.62],
"number_observations_unique": 79380,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.117
},
{
"type": "R(meas)",
"value": 0.127
},
{
"type": "R(pim)",
"value": 0.047
},
{
"type": "I/SigI",
"value": 9.9
},
{
"type": "Completeness",
"value": 69.2
},
{
"type": "Redundancy",
"value": 7.2
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.78,1.72],
"number_observations_unique": 3969,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.585
},
{
"type": "R(meas)",
"value": 0.127
},
{
"type": "R(pim)",
"value": 0.628
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "CC(1/2)",
"value": 0.452
}
]
}
]
}