Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d3b37532724e72d60bdbfe3d7a7eeb90",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 90.579,
"b": 109.214,
"c": 106.152,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.03317],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [69.72,2.50],
"number_observations": 159064,
"number_observations_unique": 18589,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.304
},
{
"type": "R(meas)",
"value": 0.324
},
{
"type": "R(pim)",
"value": 0.111
},
{
"type": "I/SigI",
"value": 6.3
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 8.6
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
"refln_shells": [
{
"resolution_limits": [2.60,2.50],
"number_observations": 18292,
"number_observations_unique": 2076,
"quality_factors": [
{
"type": "R(merge)",
"value": 4.001
},
{
"type": "R(meas)",
"value": 4.260
},
{
"type": "R(pim)",
"value": 1.443
},
{
"type": "I/SigI",
"value": 1.4
},
{
"type": "Redundancy",
"value": 8.8
},
{
"type": "CC(1/2)",
"value": 0.434
}
]
}
]
}