Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "99b2b78b87bc7128ae9a677f8b39e135",
"space_group_name": "P 1",
"unit_cell": {
"a": 45.788,
"b": 46.219,
"c": 54.181,
"alpha": 109.85,
"beta": 112.11,
"gamma": 95.52
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [34.250,2.580],
"number_observations_unique": 10184,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.075
},
{
"type": "R(meas)",
"value": 0.107
},
{
"type": "R(pim)",
"value": 0.075
},
{
"type": "I/SigI",
"value": 5.300
},
{
"type": "Completeness",
"value": 85.300
},
{
"type": "Redundancy",
"value": 1.900
},
{
"type": "CC(1/2)",
"value": 0.961
}
]
},
"refln_shells": [
{
"resolution_limits": [2.700,2.580],
"number_observations_unique": 1052,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.251
},
{
"type": "R(meas)",
"value": 0.355
},
{
"type": "R(pim)",
"value": 0.251
},
{
"type": "Completeness",
"value": 72.500
},
{
"type": "Redundancy",
"value": 1.800
},
{
"type": "CC(1/2)",
"value": 0.462
}
]
},
{
"resolution_limits": [34.250,8.950],
"number_observations_unique": 248,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.025
},
{
"type": "R(meas)",
"value": 0.035
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "Completeness",
"value": 85.500
},
{
"type": "Redundancy",
"value": 2.000
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}