Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b8ad30506f9798fa48b6ab92e482d767",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 54.482,
"b": 83.173,
"c": 109.391,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97915],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [109.39,1.92],
"number_observations_unique": 38620,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "R(meas)",
"value": 0.066
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 14.5
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 6.2
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [109.39,9.01],
"number_observations_unique": 452,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.013
},
{
"type": "R(meas)",
"value": 0.016
},
{
"type": "R(pim)",
"value": 0.008
},
{
"type": "Redundancy",
"value": 5.2
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [1.97,1.92],
"number_observations_unique": 2455,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.852
},
{
"type": "R(meas)",
"value": 2.264
},
{
"type": "R(pim)",
"value": 1.282
},
{
"type": "Redundancy",
"value": 5.1
},
{
"type": "CC(1/2)",
"value": 0.626
}
]
}
]
}