Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "aabbdd7e7c24b20e38ebb940c0e79685",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 125.771,
"b": 107.703,
"c": 75.713,
"alpha": 90.00,
"beta": 109.05,
"gamma": 90.00
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [71.530,2.300],
"number_observations_unique": 40141,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.088
},
{
"type": "I/SigI",
"value": 5.8
},
{
"type": "Completeness",
"value": 94.800
},
{
"type": "Redundancy",
"value": 2.300
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [2.360,2.300],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.705
},
{
"type": "I/SigI",
"value": 1
},
{
"type": "Completeness",
"value": 95.000
},
{
"type": "Redundancy",
"value": 2.300
},
{
"type": "CC(1/2)",
"value": 0.551
}
]
},
{
"resolution_limits": [71.530,10.290],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 19.5
},
{
"type": "Completeness",
"value": 93.400
},
{
"type": "Redundancy",
"value": 2.300
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
}
]
}