Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f73290388316b0c5146315945a364da4",
"space_group_name": "P 31",
"unit_cell": {
"a": 82.441,
"b": 82.441,
"c": 421.254,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.98000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.810,3.150],
"number_observations": 454379,
"number_observations_unique": 55218,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.322
},
{
"type": "R(meas)",
"value": 0.345
},
{
"type": "R(pim)",
"value": 0.121
},
{
"type": "I/SigI",
"value": 8.700
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 8.200
},
{
"type": "CC(1/2)",
"value": 0.984
}
]
},
"refln_shells": [
{
"resolution_limits": [3.240,3.150],
"number_observations": 37816,
"number_observations_unique": 4518,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.136
},
{
"type": "R(meas)",
"value": 2.277
},
{
"type": "R(pim)",
"value": 0.783
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 8.400
},
{
"type": "CC(1/2)",
"value": 0.681
}
]
},
{
"resolution_limits": [46.810,13.370],
"number_observations": 5083,
"number_observations_unique": 722,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.058
},
{
"type": "R(meas)",
"value": 0.063
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 19.700
},
{
"type": "Completeness",
"value": 97.100
},
{
"type": "Redundancy",
"value": 7.000
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}