Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "006f28ff30d4d9f9a6d6c16ee7c222a9",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 60.266,
"b": 60.266,
"c": 96.411,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.95386],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [52.1920,1.160],
"number_observations_unique": 70492,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "R(meas)",
"value": 0.072
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 24.200
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 19.300
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.180,1.160],
"number_observations": 57077,
"number_observations_unique": 3236,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.976
},
{
"type": "R(meas)",
"value": 2.034
},
{
"type": "R(pim)",
"value": 0.472
},
{
"type": "I/SigI",
"value": 1.700
},
{
"type": "Completeness",
"value": 94.000
},
{
"type": "Redundancy",
"value": 17.600
},
{
"type": "CC(1/2)",
"value": 0.671
}
]
},
{
"resolution_limits": [52.190,6.360],
"number_observations": 9184,
"number_observations_unique": 519,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.021
},
{
"type": "R(meas)",
"value": 0.022
},
{
"type": "R(pim)",
"value": 0.005
},
{
"type": "I/SigI",
"value": 112.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 17.700
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}