Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2123ffb62e94351ce5dc118bb14d1faa",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 72.760,
"b": 61.510,
"c": 32.704,
"alpha": 90.00,
"beta": 92.78,
"gamma": 90.00
},
"wavelengths": [0.92203],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.95,1.68],
"number_observations": 67161,
"number_observations_unique": 16268,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.195
},
{
"type": "R(meas)",
"value": 0.220
},
{
"type": "R(pim)",
"value": 0.099
},
{
"type": "I/SigI",
"value": 3.4
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 4.1
},
{
"type": "CC(1/2)",
"value": 0.980
}
]
},
"refln_shells": [
{
"resolution_limits": [1.78,1.68],
"number_observations": 7505,
"number_observations_unique": 2333,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.357
},
{
"type": "R(meas)",
"value": 1.591
},
{
"type": "R(pim)",
"value": 0.805
},
{
"type": "I/SigI",
"value": 0.7
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.434
}
]
}
]
}