Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "67833ae8ae6c4eaf16c59c235104ba19",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 115.518,
"b": 64.655,
"c": 74.441,
"alpha": 90.00,
"beta": 125.83,
"gamma": 90.00
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.76,1.77],
"number_observations": 165799,
"number_observations_unique": 43287,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "R(meas)",
"value": 0.048
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 16.4
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 3.8
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.80,1.77],
"number_observations": 8707,
"number_observations_unique": 2289,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.865
},
{
"type": "R(meas)",
"value": 1.002
},
{
"type": "R(pim)",
"value": 0.500
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Redundancy",
"value": 3.8
},
{
"type": "CC(1/2)",
"value": 0.640
}
]
}
]
}