Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "0f2952d39190266e1dda808d09b62d5d",
"space_group_name": "I 4",
"unit_cell": {
"a": 96.084,
"b": 96.084,
"c": 45.574,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [33.970,1.500],
"number_observations": 444419,
"number_observations_unique": 33453,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.157
},
{
"type": "R(meas)",
"value": 0.163
},
{
"type": "R(pim)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 10.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 13.300
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.530,1.500],
"number_observations": 17448,
"number_observations_unique": 1687,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.705
},
{
"type": "R(meas)",
"value": 3.899
},
{
"type": "R(pim)",
"value": 1.208
},
{
"type": "I/SigI",
"value": 0.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.300
},
{
"type": "CC(1/2)",
"value": 0.296
}
]
},
{
"resolution_limits": [33.970,8.220],
"number_observations": 2606,
"number_observations_unique": 225,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "R(meas)",
"value": 0.058
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 62.400
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 11.600
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}