Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8744217bb85e384a509d494c65f40e6d",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 74.237,
"b": 133.439,
"c": 147.625,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.89842],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [133.44,2.41],
"number_observations_unique": 54267,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.216
},
{
"type": "R(meas)",
"value": 0.233
},
{
"type": "R(pim)",
"value": 0.087
},
{
"type": "I/SigI",
"value": 9.2
},
{
"type": "Completeness",
"value": 94.4
},
{
"type": "Redundancy",
"value": 13.5
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [133.44,10.22],
"number_observations_unique": 875,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.04
},
{
"type": "R(meas)",
"value": 0.043
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 37.5
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 12
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [2.48,2.41],
"number_observations_unique": 4644,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.735
},
{
"type": "R(meas)",
"value": 2.951
},
{
"type": "R(pim)",
"value": 1.105
},
{
"type": "I/SigI",
"value": 1
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 13.7
},
{
"type": "CC(1/2)",
"value": 0.411
}
]
}
]
}