Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3e2c00d936f507e3a4b8c7ad1eb264cd",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 67.748,
"b": 59.842,
"c": 69.989,
"alpha": 90.00,
"beta": 98.06,
"gamma": 90.00
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [69.3,2.00],
"number_observations_unique": 35521,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.073
},
{
"type": "I/SigI",
"value": 13.90
},
{
"type": "Completeness",
"value": 94.3
},
{
"type": "Redundancy",
"value": 6.58
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.45,2.27],
"number_observations_unique": 5252,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.558
},
{
"type": "I/SigI",
"value": 3.41
},
{
"type": "Completeness",
"value": 99.3
},
{
"type": "Redundancy",
"value": 7.05
},
{
"type": "CC(1/2)",
"value": 0.898
}
]
},
{
"resolution_limits": [2.27,2.12],
"number_observations_unique": 5312,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.891
},
{
"type": "I/SigI",
"value": 1.91
},
{
"type": "Completeness",
"value": 93.5
},
{
"type": "Redundancy",
"value": 6.02
},
{
"type": "CC(1/2)",
"value": 0.761
}
]
},
{
"resolution_limits": [2.12,2.00],
"number_observations_unique": 4469,
"quality_factors": [
{
"type": "R(meas)",
"value": 1.411
},
{
"type": "I/SigI",
"value": 1.02
},
{
"type": "Completeness",
"value": 74.1
},
{
"type": "Redundancy",
"value": 5.07
},
{
"type": "CC(1/2)",
"value": 0.516
}
]
}
]
}