Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "375d3254c3f3bebfd0188f8fc94c4634",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 41.410,
"b": 74.732,
"c": 101.371,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [60.150,1.500],
"number_observations": 687457,
"number_observations_unique": 51282,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.171
},
{
"type": "R(pim)",
"value": 0.046
},
{
"type": "I/SigI",
"value": 10.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 13.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.530,1.500],
"number_observations": 34814,
"number_observations_unique": 2540,
"quality_factors": [
{
"type": "R(meas)",
"value": 1.571
},
{
"type": "R(pim)",
"value": 0.419
},
{
"type": "I/SigI",
"value": 1.200
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 13.700
},
{
"type": "CC(1/2)",
"value": 0.660
}
]
},
{
"resolution_limits": [60.200,4.070],
"number_observations": 34766,
"number_observations_unique": 2792,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.053
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 45.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 12.500
}
]
}
]
}