Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1fb46e4bf39814f96a077d0c0190c7fd",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 86.048,
"b": 56.476,
"c": 32.459,
"alpha": 90.00,
"beta": 95.51,
"gamma": 90.00
},
"wavelengths": [0.94056],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.16,1.04],
"number_observations": 414429,
"number_observations_unique": 60035,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.074
},
{
"type": "R(meas)",
"value": 0.080
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 16.4
},
{
"type": "Completeness",
"value": 81.2
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.06,1.04],
"number_observations": 4447,
"number_observations_unique": 939,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.372
},
{
"type": "R(meas)",
"value": 2.653
},
{
"type": "R(pim)",
"value": 1.163
},
{
"type": "I/SigI",
"value": 0.6
},
{
"type": "Redundancy",
"value": 4.7
},
{
"type": "CC(1/2)",
"value": 0.236
}
]
}
]
}