Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "127a0992f359939ea9a92777c83788dc",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 41.658,
"b": 29.498,
"c": 92.442,
"alpha": 90.000,
"beta": 98.457,
"gamma": 90.000
},
"wavelengths": [0.97920],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40,2.9],
"number_observations_unique": 5168,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.13
},
{
"type": "R(meas)",
"value": 0.16
},
{
"type": "R(pim)",
"value": 0.08
},
{
"type": "I/SigI",
"value": 8.2
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.99
}
]
},
"refln_shells": [
{
"resolution_limits": [3.07,2.9],
"number_observations_unique": 803,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.57
},
{
"type": "R(meas)",
"value": 0.72
},
{
"type": "R(pim)",
"value": 0.44
},
{
"type": "I/SigI",
"value": 1.7
},
{
"type": "Completeness",
"value": 99.1
},
{
"type": "Redundancy",
"value": 2.3
},
{
"type": "CC(1/2)",
"value": 0.71
}
]
}
]
}