Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d70f9653845ae201d6acb4716742b78e",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 69.21,
"b": 70.32,
"c": 228.83,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97949],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.33,2.40],
"number_observations_unique": 44525,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "R(meas)",
"value": 0.092
},
{
"type": "I/SigI",
"value": 14.0
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 6.4
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [49.33,8.98],
"number_observations_unique": 974,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "R(meas)",
"value": 0.048
},
{
"type": "I/SigI",
"value": 36.9
},
{
"type": "Redundancy",
"value": 5.2
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
{
"resolution_limits": [2.49,2.40],
"number_observations_unique": 4500,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.997
},
{
"type": "R(meas)",
"value": 1.084
},
{
"type": "I/SigI",
"value": 1.9
},
{
"type": "Redundancy",
"value": 6.5
},
{
"type": "CC(1/2)",
"value": 0.729
}
]
}
]
}