Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2d68b73cfd369bfcf2e5c880d44cc490",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 117.682,
"b": 42.213,
"c": 72.959,
"alpha": 90.00,
"beta": 109.49,
"gamma": 90.00
},
"wavelengths": [0.97800],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,1.40],
"number_observations_unique": 65204,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "R(meas)",
"value": 0.040
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 45.3
},
{
"type": "Completeness",
"value": 97.4
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.45,1.40],
"number_observations_unique": 6439,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.630
},
{
"type": "I/SigI",
"value": 2.8
},
{
"type": "Completeness",
"value": 96.6
},
{
"type": "Redundancy",
"value": 6.6
},
{
"type": "CC(1/2)",
"value": 0.848
}
]
}
]
}