Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e6221bd5736e8c4016467dd2541dcdbc",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 57.241,
"b": 58.032,
"c": 69.086,
"alpha": 90.00,
"beta": 112.83,
"gamma": 90.00
},
"wavelengths": [0.82654],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.04,1.20],
"number_observations_unique": 126373,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.058
},
{
"type": "R(meas)",
"value": 0.072
},
{
"type": "R(pim)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 10.4
},
{
"type": "Completeness",
"value": 97.4
},
{
"type": "Redundancy",
"value": 2.9
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
"refln_shells": [
{
"resolution_limits": [1.22,1.20],
"number_observations_unique": 5922,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.349
},
{
"type": "R(meas)",
"value": 1.689
},
{
"type": "R(pim)",
"value": 1.001
},
{
"type": "I/SigI",
"value": 1.8
},
{
"type": "Completeness",
"value": 92.7
},
{
"type": "Redundancy",
"value": 2.8
},
{
"type": "CC(1/2)",
"value": 0.225
}
]
}
]
}