Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3e7a1e8470544cbce6b34cce14b2ca98",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 64.397,
"b": 36.495,
"c": 61.474,
"alpha": 90.0,
"beta": 112.5,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [31.830,1.400],
"number_observations": 83610,
"number_observations_unique": 25218,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "I/SigI",
"value": 13.400
},
{
"type": "Completeness",
"value": 96.800
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.420,1.400],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.691
},
{
"type": "Completeness",
"value": 95.300
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.704
}
]
},
{
"resolution_limits": [31.830,7.540],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "Completeness",
"value": 97.800
},
{
"type": "Redundancy",
"value": 3.100
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}