Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5ada8b87063bc3f433badc83c05f6fd4",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 112.759,
"b": 53.080,
"c": 45.126,
"alpha": 90.00,
"beta": 102.32,
"gamma": 90.00
},
"wavelengths": [0.91257],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.11,1.83],
"number_observations": 75692,
"number_observations_unique": 23125,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.098
},
{
"type": "R(meas)",
"value": 0.117
},
{
"type": "R(pim)",
"value": 0.064
},
{
"type": "I/SigI",
"value": 7.1
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [1.87,1.83],
"number_observations": 4591,
"number_observations_unique": 1368,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.868
},
{
"type": "R(meas)",
"value": 2.215
},
{
"type": "R(pim)",
"value": 1.180
},
{
"type": "I/SigI",
"value": 0.5
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.335
}
]
}
]
}