Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6595b8db502f447e39b126904743e106",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 58.679,
"b": 45.828,
"c": 63.283,
"alpha": 90.00,
"beta": 111.58,
"gamma": 90.00
},
"wavelengths": [0.93230],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [58.85,1.440],
"number_observations_unique": 56651,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.042
},
{
"type": "R(meas)",
"value": 0.051
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 14.000
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.444,1.440],
"number_observations": 43015,
"number_observations_unique": 13499,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.448
},
{
"type": "R(meas)",
"value": 0.451
},
{
"type": "R(pim)",
"value": 0.247
},
{
"type": "I/SigI",
"value": 2.100
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 2.900
},
{
"type": "CC(1/2)",
"value": 0.838
}
]
}
]
}