Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "54ce90625dd6a1f26514a34d43c0fa99",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 38.464,
"b": 33.176,
"c": 64.398,
"alpha": 90.00,
"beta": 101.44,
"gamma": 90.00
},
"wavelengths": [0.92120],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [35.64,1.18],
"number_observations": 224232,
"number_observations_unique": 43375,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.060
},
{
"type": "R(meas)",
"value": 0.066
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 13.5
},
{
"type": "Completeness",
"value": 82.6
},
{
"type": "Redundancy",
"value": 5.2
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.20,1.18],
"number_observations": 577,
"number_observations_unique": 498,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.780
},
{
"type": "R(meas)",
"value": 1.096
},
{
"type": "R(pim)",
"value": 0.769
},
{
"type": "I/SigI",
"value": 0.4
},
{
"type": "Redundancy",
"value": 1.2
},
{
"type": "CC(1/2)",
"value": 0.486
}
]
}
]
}