Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6580636791b7c63b81f344ae17ac4d6e",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 114.303,
"b": 53.874,
"c": 45.233,
"alpha": 90.000,
"beta": 101.576,
"gamma": 90.000
},
"wavelengths": [0.97949],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.57,2.35],
"number_observations_unique": 11269,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "R(meas)",
"value": 0.065
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 9.7
},
{
"type": "Completeness",
"value": 99.2
},
{
"type": "Redundancy",
"value": 3
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.43,2.35],
"number_observations_unique": 1109,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.347
},
{
"type": "R(meas)",
"value": 0.418
},
{
"type": "R(pim)",
"value": 0.230
},
{
"type": "CC(1/2)",
"value": 0.889
}
]
}
]
}