Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "30d17f198f404bd6b904508973c44bfe",
"space_group_name": "I 4",
"unit_cell": {
"a": 62.49,
"b": 62.49,
"c": 36.26,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97951],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.19,1.40],
"number_observations": 122125,
"number_observations_unique": 12002,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "R(meas)",
"value": 0.033
},
{
"type": "R(pim)",
"value": 0.009
},
{
"type": "I/SigI",
"value": 30.2
},
{
"type": "Completeness",
"value": 86.2
},
{
"type": "Redundancy",
"value": 10.2
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.44,1.40],
"number_observations": 525,
"number_observations_unique": 301,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.638
},
{
"type": "R(meas)",
"value": 0.866
},
{
"type": "R(pim)",
"value": 0.579
},
{
"type": "I/SigI",
"value": 0.8
},
{
"type": "Redundancy",
"value": 1.7
},
{
"type": "CC(1/2)",
"value": 0.698
}
]
}
]
}