Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "fb7e5cfc9ece7e9209ed86b9135da773",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 58.008,
"b": 163.559,
"c": 269.466,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97860],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [78.378,2.147],
"number_observations_unique": 70477,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.112
},
{
"type": "I/SigI",
"value": 10.26
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 6.73
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [78.378,6.42],
"number_observations_unique": 2856,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.051
},
{
"type": "I/SigI",
"value": 33.70
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 6.19
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [2.43,2.28],
"number_observations_unique": 10623,
"quality_factors": [
{
"type": "R(meas)",
"value": 1.144
},
{
"type": "I/SigI",
"value": 1.46
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 7.13
},
{
"type": "CC(1/2)",
"value": 0.631
}
]
},
{
"resolution_limits": [2.28,2.147],
"number_observations_unique": 11148,
"quality_factors": [
{
"type": "R(meas)",
"value": 1.881
},
{
"type": "I/SigI",
"value": 0.71
},
{
"type": "Completeness",
"value": 98.9
},
{
"type": "Redundancy",
"value": 5.98
},
{
"type": "CC(1/2)",
"value": 0.302
}
]
}
]
}