Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "65646eb9bb60e57ee9e021e0aa98df45",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 64.548,
"b": 90.724,
"c": 73.169,
"alpha": 90.00,
"beta": 102.39,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.36,2.35],
"number_observations_unique": 32585,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.072
},
{
"type": "R(meas)",
"value": 0.088
},
{
"type": "R(pim)",
"value": 0.05
},
{
"type": "I/SigI",
"value": 25.95
},
{
"type": "Completeness",
"value": 94.51
},
{
"type": "Redundancy",
"value": 3.1
},
{
"type": "CC(1/2)",
"value": 0.987
}
]
},
"refln_shells": [
{
"resolution_limits": [2.434,2.35],
"number_observations_unique": 3286,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.431
},
{
"type": "R(meas)",
"value": 0.515
},
{
"type": "R(pim)",
"value": 0.277
},
{
"type": "Completeness",
"value": 95.36
},
{
"type": "CC(1/2)",
"value": 0.807
}
]
}
]
}