Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d27ad4aa9e088b69a04722cb992d1676",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 53.744,
"b": 72.008,
"c": 72.015,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.99900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.92,1.33],
"number_observations_unique": 58747,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.049
},
{
"type": "R(meas)",
"value": 0.055
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 14.2
},
{
"type": "Completeness",
"value": 90.0
},
{
"type": "Redundancy",
"value": 6.0
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.35,1.33],
"number_observations_unique": 2404,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.64
},
{
"type": "R(meas)",
"value": 1.907
},
{
"type": "R(pim)",
"value": 0.95
},
{
"type": "I/SigI",
"value": 0.7
},
{
"type": "CC(1/2)",
"value": 0.35
}
]
}
]
}