Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "c1981649041d3a94608a45d48046e081",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 41.277,
"b": 80.320,
"c": 45.017,
"alpha": 90.000,
"beta": 101.608,
"gamma": 90.000
},
"wavelengths": [0.97790],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.096,1.810],
"number_observations_unique": 13616,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.125
},
{
"type": "R(meas)",
"value": 0.135
},
{
"type": "R(pim)",
"value": 0.051
},
{
"type": "I/SigI",
"value": 9.0
},
{
"type": "Completeness",
"value": 89.9
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.006,1.810],
"number_observations_unique": 681,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.253
},
{
"type": "R(meas)",
"value": 1.363
},
{
"type": "R(pim)",
"value": 0.528
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Completeness",
"value": 61.5
},
{
"type": "Redundancy",
"value": 6.4
},
{
"type": "CC(1/2)",
"value": 0.445
}
]
}
]
}