Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "9d671263dd06f744c9b02b5ff3c23f1e",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 81.83,
"b": 81.83,
"c": 135.10,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.160,1.940],
"number_observations": 789134,
"number_observations_unique": 39478,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.092
},
{
"type": "R(meas)",
"value": 0.094
},
{
"type": "R(pim)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 22.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 20.000
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.990,1.940],
"number_observations": 60258,
"number_observations_unique": 2882,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.059
},
{
"type": "R(meas)",
"value": 2.110
},
{
"type": "R(pim)",
"value": 0.458
},
{
"type": "I/SigI",
"value": 2.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 20.900
},
{
"type": "CC(1/2)",
"value": 0.752
}
]
},
{
"resolution_limits": [39.160,8.680],
"number_observations": 7674,
"number_observations_unique": 519,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "R(meas)",
"value": 0.032
},
{
"type": "R(pim)",
"value": 0.008
},
{
"type": "I/SigI",
"value": 64.600
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 14.800
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}