Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "780ea1828998740d79d65eada2793408",
"space_group_name": "P 1",
"unit_cell": {
"a": 68.300,
"b": 69.100,
"c": 80.192,
"alpha": 75.52,
"beta": 79.36,
"gamma": 60.47
},
"wavelengths": [0.97926],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.810,2.420],
"number_observations": 89353,
"number_observations_unique": 42507,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "R(meas)",
"value": 0.073
},
{
"type": "R(pim)",
"value": 0.048
},
{
"type": "I/SigI",
"value": 8.900
},
{
"type": "Completeness",
"value": 90.400
},
{
"type": "Redundancy",
"value": 2.100
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.510,2.420],
"number_observations": 9696,
"number_observations_unique": 4543,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.602
},
{
"type": "R(meas)",
"value": 0.817
},
{
"type": "R(pim)",
"value": 0.548
},
{
"type": "I/SigI",
"value": 1.500
},
{
"type": "Completeness",
"value": 91.900
},
{
"type": "Redundancy",
"value": 2.100
},
{
"type": "CC(1/2)",
"value": 0.701
}
]
},
{
"resolution_limits": [48.810,9.050],
"number_observations": 1660,
"number_observations_unique": 806,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.018
},
{
"type": "R(meas)",
"value": 0.025
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 28.300
},
{
"type": "Completeness",
"value": 89.900
},
{
"type": "Redundancy",
"value": 2.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}