Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9176d372ea12396688762e2a8dd75ba6",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.562,
"b": 41.529,
"c": 72.027,
"alpha": 90.00,
"beta": 104.27,
"gamma": 90.00
},
"wavelengths": [0.98700],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.970,1.4400],
"number_observations_unique": 39673,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.061
},
{
"type": "R(meas)",
"value": 0.075
},
{
"type": "R(pim)",
"value": 0.042
},
{
"type": "I/SigI",
"value": 8.900
},
{
"type": "Completeness",
"value": 91.900
},
{
"type": "Redundancy",
"value": 2.700
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.690,2.580],
"number_observations_unique": 2187,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.000
},
{
"type": "R(meas)",
"value": 1.290
},
{
"type": "R(pim)",
"value": 0.802
},
{
"type": "Completeness",
"value": 73.000
},
{
"type": "Redundancy",
"value": 1.900
},
{
"type": "CC(1/2)",
"value": 0.777
}
]
},
{
"resolution_limits": [38.970,8.940],
"number_observations_unique": 647,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.033
},
{
"type": "R(meas)",
"value": 0.039
},
{
"type": "R(pim)",
"value": 0.021
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}