Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "3ad84a03ac475b56d293268d45755463",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 81.76,
"b": 81.76,
"c": 135.13,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [35.400,2.360],
"number_observations": 424894,
"number_observations_unique": 22128,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.133
},
{
"type": "R(meas)",
"value": 0.137
},
{
"type": "R(pim)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 17.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.420,2.360],
"number_observations": 31941,
"number_observations_unique": 1601,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.830
},
{
"type": "R(meas)",
"value": 1.878
},
{
"type": "R(pim)",
"value": 0.417
},
{
"type": "I/SigI",
"value": 2.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 20.000
},
{
"type": "CC(1/2)",
"value": 0.833
}
]
},
{
"resolution_limits": [35.400,10.550],
"number_observations": 3329,
"number_observations_unique": 290,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "R(meas)",
"value": 0.046
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 38.800
},
{
"type": "Completeness",
"value": 97.700
},
{
"type": "Redundancy",
"value": 11.500
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}