Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "ab65fc7a368dcfd3505ba292b526bc7d",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 76.635,
"b": 83.628,
"c": 61.530,
"alpha": 90.00,
"beta": 100.64,
"gamma": 90.00
},
"wavelengths": [0.97626],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [34.98,2.00],
"number_observations_unique": 25531,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.146
},
{
"type": "R(meas)",
"value": 0.157
},
{
"type": "R(pim)",
"value": 0.059
},
{
"type": "I/SigI",
"value": 6.4
},
{
"type": "Completeness",
"value": 98.7
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.05,2.00],
"number_observations_unique": 1871,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.562
},
{
"type": "R(meas)",
"value": 1.689
},
{
"type": "R(pim)",
"value": 0.635
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Completeness",
"value": 98.9
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.664
}
]
}
]
}