Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e80ecd32865e8c59b21fcbbf3ef105da",
"space_group_name": "P 43 3 2",
"unit_cell": {
"a": 138.178,
"b": 138.178,
"c": 138.178,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97625],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [69.090,1.470],
"number_observations": 5815425,
"number_observations_unique": 76716,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.134
},
{
"type": "R(meas)",
"value": 0.134
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 25.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 75.800
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.510,1.470],
"number_observations_unique": 5559,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.022
},
{
"type": "R(meas)",
"value": 3.042
},
{
"type": "R(pim)",
"value": 0.347
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 76.200
},
{
"type": "CC(1/2)",
"value": 0.831
}
]
},
{
"resolution_limits": [69.090,6.570],
"number_observations_unique": 1031,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.050
},
{
"type": "R(meas)",
"value": 0.051
},
{
"type": "R(pim)",
"value": 0.006
},
{
"type": "I/SigI",
"value": 89.8
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 65.500
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}