Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "373020c3cfcc9efdcdf7fd9814286547",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 58.462,
"b": 167.574,
"c": 117.065,
"alpha": 90.00,
"beta": 103.97,
"gamma": 90.00
},
"wavelengths": [0.97860],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30.00,2.75],
"number_observations_unique": 56199,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.100
},
{
"type": "R(meas)",
"value": 0.109
},
{
"type": "R(pim)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 16.7
},
{
"type": "Completeness",
"value": 99.2
},
{
"type": "Redundancy",
"value": 6.1
}
]
},
"refln_shells": [
{
"resolution_limits": [2.80,2.75],
"number_observations_unique": 2851,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.793
},
{
"type": "R(meas)",
"value": 0.867
},
{
"type": "R(pim)",
"value": 0.349
},
{
"type": "I/SigI",
"value": 2.2
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 6.2
},
{
"type": "CC(1/2)",
"value": 0.779
}
]
}
]
}