Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9e1f899de78280fe727d1b0e292e862a",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 50.978,
"b": 60.757,
"c": 64.229,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.140,1.800],
"number_observations": 252813,
"number_observations_unique": 19112,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.040
},
{
"type": "R(meas)",
"value": 0.041
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 29.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 13.200
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.840,1.800],
"number_observations": 13177,
"number_observations_unique": 1099,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.417
},
{
"type": "R(meas)",
"value": 2.524
},
{
"type": "R(pim)",
"value": 0.718
},
{
"type": "I/SigI",
"value": 1.100
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 12.000
},
{
"type": "CC(1/2)",
"value": 0.606
}
]
},
{
"resolution_limits": [44.140,9.000],
"number_observations": 1899,
"number_observations_unique": 193,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.017
},
{
"type": "R(meas)",
"value": 0.018
},
{
"type": "R(pim)",
"value": 0.005
},
{
"type": "I/SigI",
"value": 132.100
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 9.800
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}