Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "347d21d71e9c6c7de5df43489f7e5c78",
"space_group_name": "P 65 2 2",
"unit_cell": {
"a": 99.820,
"b": 99.820,
"c": 298.324,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97920],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [86.450,2.400],
"number_observations_unique": 17132,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.172
},
{
"type": "I/SigI",
"value": 19.1
},
{
"type": "Completeness",
"value": 92.200
},
{
"type": "Redundancy",
"value": 37.200
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.750,2.400],
"number_observations": 30227,
"number_observations_unique": 857,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.410
},
{
"type": "Completeness",
"value": 84.800
},
{
"type": "Redundancy",
"value": 35.300
},
{
"type": "CC(1/2)",
"value": 0.696
}
]
},
{
"resolution_limits": [86.450,8.850],
"number_observations": 23809,
"number_observations_unique": 856,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 27.800
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}