Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3af0b341c6038e91f6a9e2422169f7e3",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 72.924,
"b": 61.401,
"c": 32.549,
"alpha": 90.00,
"beta": 93.12,
"gamma": 90.00
},
"wavelengths": [0.94054],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.97,1.45],
"number_observations": 175045,
"number_observations_unique": 25421,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.162
},
{
"type": "R(meas)",
"value": 0.175
},
{
"type": "R(pim)",
"value": 0.066
},
{
"type": "I/SigI",
"value": 3.6
},
{
"type": "Completeness",
"value": 98.8
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [1.47,1.45],
"number_observations": 8210,
"number_observations_unique": 1172,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.761
},
{
"type": "R(meas)",
"value": 1.901
},
{
"type": "R(pim)",
"value": 0.709
},
{
"type": "I/SigI",
"value": 0.2
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.354
}
]
}
]
}