Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "42def045874ed62c909e2f3a39762c8f",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 62.704,
"b": 71.156,
"c": 78.386,
"alpha": 90.00,
"beta": 110.04,
"gamma": 90.00
},
"wavelengths": [0.95373],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.38,1.67],
"number_observations": 344784,
"number_observations_unique": 75438,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.135
},
{
"type": "R(meas)",
"value": 0.153
},
{
"type": "R(pim)",
"value": 0.071
},
{
"type": "I/SigI",
"value": 6.3
},
{
"type": "Completeness",
"value": 99.5
},
{
"type": "Redundancy",
"value": 4.6
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [1.69,1.67],
"number_observations": 15533,
"number_observations_unique": 3505,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.309
},
{
"type": "R(meas)",
"value": 1.481
},
{
"type": "R(pim)",
"value": 0.683
},
{
"type": "I/SigI",
"value": 0.8
},
{
"type": "Redundancy",
"value": 4.4
},
{
"type": "CC(1/2)",
"value": 0.453
}
]
}
]
}