Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d9c729359f9840cd9aac3f23d5cd4b1f",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 25.139,
"b": 72.618,
"c": 33.893,
"alpha": 90.00,
"beta": 106.39,
"gamma": 90.00
},
"wavelengths": [0.97858],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [36.31,1.84],
"number_observations_unique": 10034,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.112
},
{
"type": "R(meas)",
"value": 0.134
},
{
"type": "R(pim)",
"value": 0.072
},
{
"type": "I/SigI",
"value": 6.0
},
{
"type": "Completeness",
"value": 98.7
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [1.88,1.84],
"quality_factors": [
{
"type": "R(merge)",
"value": 1.225
},
{
"type": "R(meas)",
"value": 1.542
},
{
"type": "R(pim)",
"value": 0.921
},
{
"type": "I/SigI",
"value": 0.8
},
{
"type": "Completeness",
"value": 84.2
},
{
"type": "Redundancy",
"value": 2.1
},
{
"type": "CC(1/2)",
"value": 0.58
}
]
}
]
}