Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3b5a7d476124cd1752927ae84e85eab8",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 48.505,
"b": 62.621,
"c": 62.043,
"alpha": 90.00,
"beta": 104.97,
"gamma": 90.00
},
"wavelengths": [0.96600],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.860,1.970],
"number_observations": 73950,
"number_observations_unique": 24858,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.111
},
{
"type": "R(meas)",
"value": 0.134
},
{
"type": "R(pim)",
"value": 0.074
},
{
"type": "I/SigI",
"value": 4.700
},
{
"type": "Completeness",
"value": 97.300
},
{
"type": "Redundancy",
"value": 3.000
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
"refln_shells": [
{
"resolution_limits": [2.020,1.970],
"number_observations_unique": 1559,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.060
},
{
"type": "R(meas)",
"value": 1.281
},
{
"type": "R(pim)",
"value": 0.711
},
{
"type": "Completeness",
"value": 86.300
},
{
"type": "Redundancy",
"value": 3.000
},
{
"type": "CC(1/2)",
"value": 0.472
}
]
},
{
"resolution_limits": [46.860,9.020],
"number_observations_unique": 280,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.061
},
{
"type": "R(meas)",
"value": 0.072
},
{
"type": "R(pim)",
"value": 0.038
},
{
"type": "Completeness",
"value": 98.200
},
{
"type": "Redundancy",
"value": 3.000
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
}
]
}