Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "81341bd823d93ad2d9916c05d9ee8d46",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 86.624,
"b": 56.861,
"c": 64.975,
"alpha": 90.00,
"beta": 94.78,
"gamma": 90.00
},
"wavelengths": [0.92203],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [64.74,1.15],
"number_observations": 448293,
"number_observations_unique": 85186,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "R(meas)",
"value": 0.060
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 21.1
},
{
"type": "Completeness",
"value": 76.4
},
{
"type": "Redundancy",
"value": 5.3
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.17,1.15],
"number_observations": 288,
"number_observations_unique": 286,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.281
},
{
"type": "R(meas)",
"value": 0.398
},
{
"type": "R(pim)",
"value": 0.281
},
{
"type": "I/SigI",
"value": 0.7
},
{
"type": "Redundancy",
"value": 1.0
},
{
"type": "CC(1/2)",
"value": 0.450
}
]
}
]
}