Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b3396668f9aab50b23db5d916e118261",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 51.656,
"b": 70.193,
"c": 113.167,
"alpha": 90.00,
"beta": 90.96,
"gamma": 90.00
},
"wavelengths": [0.96600],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [59.65,2.20],
"number_observations_unique": 40517,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "R(meas)",
"value": 0.039
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 11.4
},
{
"type": "Completeness",
"value": 98.2
},
{
"type": "Redundancy",
"value": 2.5
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.27,2.20],
"number_observations_unique": 3536,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.309
},
{
"type": "R(meas)",
"value": 0.437
},
{
"type": "R(pim)",
"value": 0.309
},
{
"type": "I/SigI",
"value": 1.7
},
{
"type": "Completeness",
"value": 98.9
},
{
"type": "Redundancy",
"value": 2.5
},
{
"type": "CC(1/2)",
"value": 0.877
}
]
}
]
}