Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8e8d8b11d7f7463b5be19514d06a237d",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 36.811,
"b": 37.365,
"c": 90.232,
"alpha": 90.000,
"beta": 98.981,
"gamma": 90.000
},
"wavelengths": [0.99980],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [34.46,2.15],
"number_observations_unique": 13455,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.072
},
{
"type": "I/SigI",
"value": 13.37
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 6.61
},
{
"type": "CC(1/2)",
"value": 1.00
}
]
},
"refln_shells": [
{
"resolution_limits": [2.28,2.15],
"number_observations_unique": 2156,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.128
},
{
"type": "I/SigI",
"value": 1.61
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 6.78
},
{
"type": "CC(1/2)",
"value": 0.70
}
]
}
]
}