Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "dc7c8378070b72d75100765860b81c37",
"space_group_name": "P 1",
"unit_cell": {
"a": 29.678,
"b": 47.144,
"c": 88.518,
"alpha": 102.61,
"beta": 93.88,
"gamma": 108.34
},
"wavelengths": [0.96598],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.28,1.75],
"number_observations_unique": 40054,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.047
},
{
"type": "I/SigI",
"value": 8.500
},
{
"type": "Completeness",
"value": 90.4
},
{
"type": "Redundancy",
"value": 1.8
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.78,1.75],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.494
},
{
"type": "Completeness",
"value": 77.8
},
{
"type": "Redundancy",
"value": 1.6
},
{
"type": "CC(1/2)",
"value": 0.76
}
]
},
{
"resolution_limits": [43.28,8.620],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.021
},
{
"type": "Completeness",
"value": 93.900
},
{
"type": "Redundancy",
"value": 2.000
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}