Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "245193795a21e00029ec180f4f351152",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 51.78,
"b": 57.38,
"c": 115.09,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [19.750,1.970],
"number_observations": 163246,
"number_observations_unique": 24967,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.186
},
{
"type": "R(meas)",
"value": 0.202
},
{
"type": "R(pim)",
"value": 0.078
},
{
"type": "I/SigI",
"value": 7.300
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.500
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [2.020,1.970],
"number_observations": 12111,
"number_observations_unique": 1788,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.784
},
{
"type": "R(meas)",
"value": 1.933
},
{
"type": "R(pim)",
"value": 0.737
},
{
"type": "I/SigI",
"value": 1.000
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.619
}
]
},
{
"resolution_limits": [19.750,8.810],
"number_observations": 1853,
"number_observations_unique": 309,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "R(meas)",
"value": 0.047
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 29.300
},
{
"type": "Completeness",
"value": 91.700
},
{
"type": "Redundancy",
"value": 6.000
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}