Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "57e93692874aaff14c9a6457ecd2e0f5",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 220.167,
"b": 65.202,
"c": 204.023,
"alpha": 90.000,
"beta": 94.466,
"gamma": 90.000
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,2.85],
"number_observations_unique": 68147,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.128
},
{
"type": "R(meas)",
"value": 0.138
},
{
"type": "R(pim)",
"value": 0.052
},
{
"type": "I/SigI",
"value": 10.8
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.92,2.85],
"number_observations": 32042,
"number_observations_unique": 4513,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.918
},
{
"type": "R(meas)",
"value": 2.068
},
{
"type": "R(pim)",
"value": 0.769
},
{
"type": "I/SigI",
"value": 1.2
},
{
"type": "Redundancy",
"value": 7.1
},
{
"type": "CC(1/2)",
"value": 0.588
}
]
}
]
}