Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6ceb4477176faa6d6b984ba304b4c3b1",
"space_group_name": "P 31 2 1",
"unit_cell": {
"a": 94.872,
"b": 94.872,
"c": 32.539,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.440,2.350],
"number_observations": 77949,
"number_observations_unique": 7207,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.248
},
{
"type": "R(meas)",
"value": 0.260
},
{
"type": "R(pim)",
"value": 0.078
},
{
"type": "I/SigI",
"value": 9.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.800
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [2.430,2.350],
"number_observations": 7848,
"number_observations_unique": 693,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.614
},
{
"type": "R(meas)",
"value": 1.691
},
{
"type": "R(pim)",
"value": 0.499
},
{
"type": "I/SigI",
"value": 1.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.300
},
{
"type": "CC(1/2)",
"value": 0.816
}
]
},
{
"resolution_limits": [47.440,9.100],
"number_observations": 1492,
"number_observations_unique": 144,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "R(meas)",
"value": 0.055
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 35.500
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 10.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}