Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e135cae0355815b0329e6f5d2c450422",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 81.961,
"b": 27.434,
"c": 56.421,
"alpha": 90.0,
"beta": 99.8,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.620,1.150],
"number_observations": 174779,
"number_observations_unique": 33135,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.042
},
{
"type": "R(meas)",
"value": 0.047
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 28.100
},
{
"type": "Completeness",
"value": 74.700
},
{
"type": "Redundancy",
"value": 5.300
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [1.170,1.150],
"number_observations": 134,
"number_observations_unique": 133,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.069
},
{
"type": "R(meas)",
"value": 0.079
},
{
"type": "R(pim)",
"value": 0.037
},
{
"type": "I/SigI",
"value": 1.100
},
{
"type": "Completeness",
"value": 5.900
},
{
"type": "Redundancy",
"value": 1.000
},
{
"type": "CC(1/2)",
"value": 0.980
}
]
},
{
"resolution_limits": [55.620,6.190],
"number_observations": 1868,
"number_observations_unique": 325,
"quality_factors": [
{
"type": "I/SigI",
"value": 86.000
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 5.700
}
]
}
]
}