Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a6a44cdb9c591f1df8f037a26f8c8881",
"space_group_name": "P 31 2 1",
"unit_cell": {
"a": 89.541,
"b": 89.541,
"c": 106.301,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.96874],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [53.15,1.980],
"number_observations": 111660,
"number_observations_unique": 33204,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.12
},
{
"type": "R(meas)",
"value": 0.141
},
{
"type": "I/SigI",
"value": 6.7
},
{
"type": "Completeness",
"value": 95.21
},
{
"type": "CC(1/2)",
"value": 0.911
}
]
},
"refln_shells": [
{
"resolution_limits": [2.01,1.98],
"number_observations": 5630,
"number_observations_unique": 1603,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.384
},
{
"type": "R(meas)",
"value": 1.615
},
{
"type": "I/SigI",
"value": 0.7
},
{
"type": "Completeness",
"value": 92.61
},
{
"type": "CC(1/2)",
"value": 0.329
}
]
},
{
"resolution_limits": [53.17,5.37],
"number_observations": 5680,
"number_observations_unique": 1830,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.11
},
{
"type": "R(meas)",
"value": 0.133
},
{
"type": "I/SigI",
"value": 20
},
{
"type": "Completeness",
"value": 97.08
},
{
"type": "CC(1/2)",
"value": 0.874
}
]
}
]
}