Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1d5321c8695cd4172fea4e3afa95c0c6",
"space_group_name": "P 31 2 1",
"unit_cell": {
"a": 89.555,
"b": 89.555,
"c": 106.318,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.96874],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.78,2.15],
"number_observations": 616792,
"number_observations_unique": 27364,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.533
},
{
"type": "R(meas)",
"value": 0.546
},
{
"type": "I/SigI",
"value": 5.0
},
{
"type": "Completeness",
"value": 99.99
},
{
"type": "CC(1/2)",
"value": 0.989
}
]
},
"refln_shells": [
{
"resolution_limits": [2.19,2.15],
"number_observations": 30180,
"number_observations_unique": 1349,
"quality_factors": [
{
"type": "R(merge)",
"value": 7.114
},
{
"type": "R(meas)",
"value": 7.286
},
{
"type": "I/SigI",
"value": 0.4
},
{
"type": "Completeness",
"value": 100
},
{
"type": "CC(1/2)",
"value": 0.333
}
]
},
{
"resolution_limits": [44.79,5.83],
"number_observations": 31659,
"number_observations_unique": 1500,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.172
},
{
"type": "R(meas)",
"value": 0.176
},
{
"type": "I/SigI",
"value": 19.4
},
{
"type": "Completeness",
"value": 99.87
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
}
]
}