Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4bf7849f63e544e94255c6361f6b32ba",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 125.749,
"b": 125.749,
"c": 75.061,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97857],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [62.870,2.410],
"number_observations": 580318,
"number_observations_unique": 26601,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.118
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 22.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 21.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.510,2.410],
"number_observations": 57745,
"number_observations_unique": 2789,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.611
},
{
"type": "R(pim)",
"value": 0.137
},
{
"type": "I/SigI",
"value": 5.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 20.700
},
{
"type": "CC(1/2)",
"value": 0.972
}
]
},
{
"resolution_limits": [62.870,9.040],
"number_observations": 11256,
"number_observations_unique": 564,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.064
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 50.500
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 20.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}