Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e5bee3812208102870bd648b8212029e",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.37,
"b": 41.30,
"c": 72.25,
"alpha": 90.000,
"beta": 104.366,
"gamma": 90.000
},
"wavelengths": [0.97170],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [69.991,1.206],
"number_observations_unique": 58672,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "R(meas)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 23.58
},
{
"type": "Completeness",
"value": 78.5
},
{
"type": "Redundancy",
"value": 5.45
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.24,1.21],
"number_observations_unique": 679,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.241
},
{
"type": "R(meas)",
"value": 0.339
},
{
"type": "I/SigI",
"value": 2.33
},
{
"type": "Completeness",
"value": 12.4
},
{
"type": "Redundancy",
"value": 1.65
},
{
"type": "CC(1/2)",
"value": 0.855
}
]
}
]
}