Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "25633365889b07a689fc9fb4e18b8c4e",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 81.403,
"b": 96.831,
"c": 57.784,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [28.890,1.650],
"number_observations": 173049,
"number_observations_unique": 25139,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "R(meas)",
"value": 0.076
},
{
"type": "R(pim)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 14.000
},
{
"type": "Completeness",
"value": 91.100
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.680,1.650],
"number_observations": 4184,
"number_observations_unique": 839,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.996
},
{
"type": "R(meas)",
"value": 1.104
},
{
"type": "R(pim)",
"value": 0.462
},
{
"type": "I/SigI",
"value": 1.400
},
{
"type": "Completeness",
"value": 60.700
},
{
"type": "Redundancy",
"value": 5.000
},
{
"type": "CC(1/2)",
"value": 0.736
}
]
},
{
"resolution_limits": [28.890,8.900],
"number_observations": 1262,
"number_observations_unique": 204,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "R(meas)",
"value": 0.037
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 37.700
},
{
"type": "Completeness",
"value": 96.900
},
{
"type": "Redundancy",
"value": 6.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}