Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ee1e8a5c2d26678781a3544a18289e41",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 51.03,
"b": 65.64,
"c": 86.67,
"alpha": 90.00,
"beta": 100.23,
"gamma": 90.00
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [65.64,2.90],
"number_observations_unique": 12620,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.170
},
{
"type": "R(meas)",
"value": 0.185
},
{
"type": "R(pim)",
"value": 0.071
},
{
"type": "I/SigI",
"value": 10.1
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 6.6
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [3.08,2.9],
"number_observations_unique": 2021,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.953
},
{
"type": "R(meas)",
"value": 1.033
},
{
"type": "R(pim)",
"value": 0.542
},
{
"type": "I/SigI",
"value": 2.2
},
{
"type": "Completeness",
"value": 99.5
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.743
}
]
}
]
}