Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a99bf775b219cf8987761b71954fff99",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 72.426,
"b": 61.882,
"c": 65.294,
"alpha": 90.00,
"beta": 93.19,
"gamma": 90.00
},
"wavelengths": [0.92201],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [65.18,1.15],
"number_observations": 410062,
"number_observations_unique": 78281,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.061
},
{
"type": "R(meas)",
"value": 0.066
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 14.7
},
{
"type": "Completeness",
"value": 76.8
},
{
"type": "Redundancy",
"value": 5.2
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.17,1.15],
"number_observations": 266,
"number_observations_unique": 264,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.783
},
{
"type": "R(meas)",
"value": 0.978
},
{
"type": "R(pim)",
"value": 0.775
},
{
"type": "I/SigI",
"value": 0.4
},
{
"type": "Redundancy",
"value": 1.0
},
{
"type": "CC(1/2)",
"value": 0.675
}
]
}
]
}