Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "34072df68c20db379a8dfd92a44d7ece",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 64.62,
"b": 135.01,
"c": 73.78,
"alpha": 90.00,
"beta": 107.45,
"gamma": 90.00
},
"wavelengths": [1.11503],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.720,2.400],
"number_observations_unique": 46906,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.116
},
{
"type": "R(meas)",
"value": 0.126
},
{
"type": "R(pim)",
"value": 0.050
},
{
"type": "I/SigI",
"value": 12.300
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.480,2.400],
"number_observations_unique": 4617,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.844
},
{
"type": "R(meas)",
"value": 0.931
},
{
"type": "R(pim)",
"value": 0.386
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 5.600
},
{
"type": "CC(1/2)",
"value": 0.670
}
]
},
{
"resolution_limits": [48.720,9.300],
"number_observations_unique": 826,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.035
},
{
"type": "R(meas)",
"value": 0.038
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 7.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}