Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8ad1145b9b152061bcea04726895fde6",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 43.77,
"b": 62.92,
"c": 66.16,
"alpha": 90.00,
"beta": 107.31,
"gamma": 90.00
},
"wavelengths": [0.97851],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.58,2.30],
"number_observations": 59586,
"number_observations_unique": 15194,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.208
},
{
"type": "R(meas)",
"value": 0.240
},
{
"type": "R(pim)",
"value": 0.120
},
{
"type": "I/SigI",
"value": 5.4
},
{
"type": "Completeness",
"value": 99.1
},
{
"type": "Redundancy",
"value": 3.9
},
{
"type": "CC(1/2)",
"value": 0.977
}
]
},
"refln_shells": [
{
"resolution_limits": [2.39,2.30],
"number_observations": 6137,
"number_observations_unique": 1570,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.637
},
{
"type": "R(meas)",
"value": 0.738
},
{
"type": "R(pim)",
"value": 0.368
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Redundancy",
"value": 3.9
},
{
"type": "CC(1/2)",
"value": 0.755
}
]
}
]
}