Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "bb4d1689cffb8984e74c2296bf72bea8",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 40.884,
"b": 71.139,
"c": 41.719,
"alpha": 90.000,
"beta": 110.334,
"gamma": 90.000
},
"wavelengths": [0.91908],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.12,1.75],
"number_observations_unique": 43032,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.112
},
{
"type": "R(meas)",
"value": 0.123
},
{
"type": "R(pim)",
"value": 0.050
},
{
"type": "I/SigI",
"value": 18.5
},
{
"type": "Completeness",
"value": 97.4
},
{
"type": "Redundancy",
"value": 6.2
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
"refln_shells": [
{
"resolution_limits": [1.79,1.75],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.577
},
{
"type": "R(meas)",
"value": 0.669
},
{
"type": "R(pim)",
"value": 0.327
},
{
"type": "I/SigI",
"value": 1.45
},
{
"type": "Completeness",
"value": 80
},
{
"type": "Redundancy",
"value": 4.1
}
]
}
]
}