Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "b529b80792c6cb4a8b49943575a9a5ef",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 56.453,
"b": 105.698,
"c": 175.496,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [52.85,1.75],
"number_observations": 1435859,
"number_observations_unique": 106783,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.129
},
{
"type": "R(meas)",
"value": 0.134
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 11.2
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 13.4
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.78,1.75],
"number_observations": 72061,
"number_observations_unique": 5224,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.518
},
{
"type": "R(meas)",
"value": 2.615
},
{
"type": "R(pim)",
"value": 0.702
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Redundancy",
"value": 13.8
},
{
"type": "CC(1/2)",
"value": 0.518
}
]
}
]
}