Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "80abb76b3adcbc8a02293bb406b237a9",
"space_group_name": "I 4",
"unit_cell": {
"a": 95.50,
"b": 95.50,
"c": 45.84,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92134],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.330,1.500],
"number_observations": 438729,
"number_observations_unique": 33253,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.236
},
{
"type": "R(meas)",
"value": 0.246
},
{
"type": "R(pim)",
"value": 0.067
},
{
"type": "I/SigI",
"value": 10.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 13.200
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.540,1.500],
"number_observations": 26065,
"number_observations_unique": 2472,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.049
},
{
"type": "R(meas)",
"value": 3.206
},
{
"type": "R(pim)",
"value": 0.982
},
{
"type": "I/SigI",
"value": 0.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.500
},
{
"type": "CC(1/2)",
"value": 0.342
}
]
},
{
"resolution_limits": [41.330,6.710],
"number_observations": 4758,
"number_observations_unique": 405,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.061
},
{
"type": "R(meas)",
"value": 0.064
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 40.000
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 11.700
},
{
"type": "CC(1/2)",
"value": 0.980
}
]
}
]
}