Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "be14efc1e9febb946a91675748463627",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 98.715,
"b": 72.827,
"c": 65.343,
"alpha": 90.00,
"beta": 109.38,
"gamma": 90.00
},
"wavelengths": [0.95000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.07,1.71],
"number_observations": 326844,
"number_observations_unique": 47090,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.227
},
{
"type": "R(meas)",
"value": 0.246
},
{
"type": "R(pim)",
"value": 0.093
},
{
"type": "I/SigI",
"value": 4.9
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [1.74,1.71],
"number_observations": 16447,
"number_observations_unique": 2464,
"quality_factors": [
{
"type": "R(merge)",
"value": 7.116
},
{
"type": "R(meas)",
"value": 7.801
},
{
"type": "R(pim)",
"value": 3.100
},
{
"type": "I/SigI",
"value": 0.8
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.463
}
]
}
]
}