Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "037e3d126a34056dd30855d3d3b41376",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 109.764,
"b": 115.494,
"c": 240.758,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.150,2.290],
"number_observations": 938116,
"number_observations_unique": 68595,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.075
},
{
"type": "R(meas)",
"value": 0.078
},
{
"type": "R(pim)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 22.500
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 13.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.350,2.290],
"number_observations": 59880,
"number_observations_unique": 4460,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.747
},
{
"type": "R(meas)",
"value": 0.776
},
{
"type": "R(pim)",
"value": 0.208
},
{
"type": "I/SigI",
"value": 4.000
},
{
"type": "Completeness",
"value": 97.500
},
{
"type": "Redundancy",
"value": 13.400
},
{
"type": "CC(1/2)",
"value": 0.882
}
]
},
{
"resolution_limits": [48.150,10.760],
"number_observations": 9011,
"number_observations_unique": 754,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.035
},
{
"type": "R(meas)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 56.400
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 12.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}