Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "f24d0a8557ddebd3ea3ffeb16f0db296",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 81.67,
"b": 81.67,
"c": 135.29,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [26.730,2.120],
"number_observations": 582326,
"number_observations_unique": 30305,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "R(meas)",
"value": 0.087
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 20.700
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 19.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.180,2.120],
"number_observations": 44237,
"number_observations_unique": 2204,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.748
},
{
"type": "R(meas)",
"value": 1.793
},
{
"type": "R(pim)",
"value": 0.398
},
{
"type": "I/SigI",
"value": 2.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 20.100
},
{
"type": "CC(1/2)",
"value": 0.862
}
]
},
{
"resolution_limits": [26.730,9.480],
"number_observations": 4727,
"number_observations_unique": 384,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "R(meas)",
"value": 0.041
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 49.100
},
{
"type": "Completeness",
"value": 96.000
},
{
"type": "Redundancy",
"value": 12.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}