Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4ef6732c903d97cf3537461f72936f23",
"space_group_name": "P 2 21 21",
"unit_cell": {
"a": 25.975,
"b": 41.504,
"c": 52.208,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97924],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [19.280,1.400],
"number_observations": 105356,
"number_observations_unique": 11493,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.064
},
{
"type": "R(meas)",
"value": 0.068
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 16.500
},
{
"type": "Completeness",
"value": 98.500
},
{
"type": "Redundancy",
"value": 9.200
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.420,1.400],
"number_observations": 3536,
"number_observations_unique": 552,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.540
},
{
"type": "R(meas)",
"value": 0.591
},
{
"type": "R(pim)",
"value": 0.229
},
{
"type": "I/SigI",
"value": 2.400
},
{
"type": "Completeness",
"value": 96.600
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.956
}
]
},
{
"resolution_limits": [19.280,7.670],
"number_observations": 628,
"number_observations_unique": 87,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.089
},
{
"type": "R(meas)",
"value": 0.095
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 28.900
},
{
"type": "Completeness",
"value": 91.800
},
{
"type": "Redundancy",
"value": 7.200
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
}
]
}