Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "f8e41fb3520b941b365e3945e1329ecb",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 32.374,
"b": 47.383,
"c": 79.030,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.87310],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.64,1.310],
"number_observations_unique": 29805,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.109
},
{
"type": "R(meas)",
"value": 0.127
},
{
"type": "R(pim)",
"value": 0.062
},
{
"type": "I/SigI",
"value": 5.7
},
{
"type": "Completeness",
"value": 99.2
},
{
"type": "Redundancy",
"value": 3.9
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.332,1.31],
"number_observations_unique": 1470,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.310
},
{
"type": "R(meas)",
"value": 1.529
},
{
"type": "R(pim)",
"value": 0.771
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "CC(1/2)",
"value": 0.444
}
]
}
]
}