Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "93c67082e40579a0a960c0298c8c9c9b",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 109.834,
"b": 109.834,
"c": 57.524,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.120,2.70],
"number_observations": 170587,
"number_observations_unique": 9693,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.137
},
{
"type": "R(meas)",
"value": 0.143
},
{
"type": "R(pim)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 15.200
},
{
"type": "Completeness",
"value": 95.100
},
{
"type": "Redundancy",
"value": 12.600
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [3.10,2.70],
"number_observations": 24080,
"number_observations_unique": 2028,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.201
},
{
"type": "R(meas)",
"value": 1.256
},
{
"type": "R(pim)",
"value": 0.363
},
{
"type": "I/SigI",
"value": 2.900
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 11.900
},
{
"type": "CC(1/2)",
"value": 0.729
}
]
},
{
"resolution_limits": [49.120,7.600],
"number_observations": 5922,
"number_observations_unique": 535,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "R(meas)",
"value": 0.074
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 30.100
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 11.100
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
}
]
}