Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "764f1dc108f9f4596f9c1c99673bc3c8",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 32.697,
"b": 64.098,
"c": 79.148,
"alpha": 90.000,
"beta": 95.891,
"gamma": 90.000
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.37,1.15],
"number_observations_unique": 113597,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "R(meas)",
"value": 0.050
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 18.1
},
{
"type": "Completeness",
"value": 98.6
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.21,1.15],
"number_observations_unique": 15961,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.810
},
{
"type": "R(meas)",
"value": 0.879
},
{
"type": "R(pim)",
"value": 0.336
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Completeness",
"value": 94.9
},
{
"type": "Redundancy",
"value": 6.6
},
{
"type": "CC(1/2)",
"value": 0.782
}
]
}
]
}