Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9af6ee40c4629d6b3cb452b7cc9c4845",
"space_group_name": "P 62 2 2",
"unit_cell": {
"a": 102.454,
"b": 102.454,
"c": 113.348,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.00530],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.7620,2.400],
"number_observations_unique": 14321,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.103
},
{
"type": "R(meas)",
"value": 0.107
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 21.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 16.300
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.490,2.400],
"number_observations_unique": 1467,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.141
},
{
"type": "R(meas)",
"value": 1.177
},
{
"type": "R(pim)",
"value": 0.287
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 16.600
},
{
"type": "CC(1/2)",
"value": 0.842
}
]
},
{
"resolution_limits": [47.760,8.980],
"number_observations_unique": 341,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "R(meas)",
"value": 0.056
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 12.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}