Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "90d93f4b510042b30bf514e5e06f0bb7",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 89.169,
"b": 105.829,
"c": 259.275,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97946],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.890,2.750],
"number_observations": 193715,
"number_observations_unique": 60381,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.171
},
{
"type": "R(meas)",
"value": 0.204
},
{
"type": "R(pim)",
"value": 0.108
},
{
"type": "I/SigI",
"value": 6.100
},
{
"type": "Completeness",
"value": 93.900
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.975
}
]
},
"refln_shells": [
{
"resolution_limits": [2.820,2.750],
"number_observations_unique": 4302,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.853
},
{
"type": "R(meas)",
"value": 1.033
},
{
"type": "R(pim)",
"value": 0.569
},
{
"type": "Completeness",
"value": 95.700
},
{
"type": "Redundancy",
"value": 3.000
},
{
"type": "CC(1/2)",
"value": 0.363
}
]
},
{
"resolution_limits": [38.890,12.600],
"number_observations_unique": 674,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "R(meas)",
"value": 0.068
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "Completeness",
"value": 89.800
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
}
]
}