Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "c6f4bad3a914f71897e77c12161deb5d",
"space_group_name": "P 31 2 1",
"unit_cell": {
"a": 74.968,
"b": 74.968,
"c": 94.100,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.87313],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [94.10,2.90],
"number_observations_unique": 7143,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.455
},
{
"type": "R(meas)",
"value": 0.482
},
{
"type": "R(pim)",
"value": 0.159
},
{
"type": "I/SigI",
"value": 7.7
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 16.8
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [94.10,8.70],
"number_observations_unique": 311,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.105
},
{
"type": "R(meas)",
"value": 0.112
},
{
"type": "R(pim)",
"value": 0.039
},
{
"type": "I/SigI",
"value": 19.0
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 13.1
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
{
"resolution_limits": [3.08,2.90],
"number_observations_unique": 1123,
"quality_factors": [
{
"type": "R(merge)",
"value": 5.713
},
{
"type": "R(meas)",
"value": 6.047
},
{
"type": "R(pim)",
"value": 1.978
},
{
"type": "I/SigI",
"value": 1.1
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 17.4
},
{
"type": "CC(1/2)",
"value": 0.380
}
]
}
]
}