Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "0346a04184a2fb7d17272574f6f09e36",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 60.278,
"b": 70.779,
"c": 72.108,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.40000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.250,1.828],
"number_observations_unique": 27792,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.119
},
{
"type": "R(meas)",
"value": 0.125
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 19.100
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 11.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.870,1.830],
"number_observations": 14099,
"number_observations_unique": 1571,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.161
},
{
"type": "R(meas)",
"value": 1.231
},
{
"type": "R(pim)",
"value": 0.396
},
{
"type": "I/SigI",
"value": 2.200
},
{
"type": "Completeness",
"value": 92.300
},
{
"type": "Redundancy",
"value": 9.000
},
{
"type": "CC(1/2)",
"value": 0.654
}
]
},
{
"resolution_limits": [46.250,8.960],
"number_observations": 2740,
"number_observations_unique": 289,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "R(meas)",
"value": 0.045
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 56.100
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 9.500
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}