Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b4f7fe6b92d77cc1436f8286eb0b5362",
"space_group_name": "P 64 2 2",
"unit_cell": {
"a": 129.683,
"b": 129.683,
"c": 302.305,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [105.28,2.18],
"number_observations_unique": 49107,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "I/SigI",
"value": 29.8
},
{
"type": "Completeness",
"value": 62.0
},
{
"type": "Redundancy",
"value": 38.5
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [105.28,7.23],
"number_observations_unique": 2454,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 95.5
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 33.1
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [2.43,2.18],
"number_observations_unique": 2456,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.180
},
{
"type": "I/SigI",
"value": 2.2
},
{
"type": "Completeness",
"value": 11.4
},
{
"type": "Redundancy",
"value": 34.4
},
{
"type": "CC(1/2)",
"value": 0.825
}
]
}
]
}