Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "240b537625c820dbbf77e52d7599094d",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 191.607,
"b": 63.036,
"c": 158.006,
"alpha": 90.00,
"beta": 117.44,
"gamma": 90.00
},
"wavelengths": [0.90000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,1.550],
"number_observations_unique": 232158,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.125
},
{
"type": "I/SigI",
"value": 10.900
},
{
"type": "Completeness",
"value": 95.500
},
{
"type": "Redundancy",
"value": 5.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.610,1.550],
"number_observations_unique": 23058,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.499
},
{
"type": "Completeness",
"value": 95.400
},
{
"type": "Redundancy",
"value": 4.900
}
]
},
{
"resolution_limits": [1.670,1.610],
"number_observations_unique": 22988,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.397
},
{
"type": "Completeness",
"value": 95.200
},
{
"type": "Redundancy",
"value": 4.800
}
]
},
{
"resolution_limits": [1.750,1.670],
"number_observations_unique": 23197,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.320
},
{
"type": "Completeness",
"value": 95.600
},
{
"type": "Redundancy",
"value": 4.700
}
]
},
{
"resolution_limits": [1.840,1.750],
"number_observations_unique": 23164,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.257
},
{
"type": "Completeness",
"value": 95.700
},
{
"type": "Redundancy",
"value": 4.600
}
]
},
{
"resolution_limits": [1.950,1.840],
"number_observations_unique": 23212,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.205
},
{
"type": "Completeness",
"value": 95.900
},
{
"type": "Redundancy",
"value": 4.500
}
]
},
{
"resolution_limits": [2.100,1.950],
"number_observations_unique": 23343,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.165
},
{
"type": "Completeness",
"value": 95.900
},
{
"type": "Redundancy",
"value": 4.500
}
]
},
{
"resolution_limits": [2.320,2.100],
"number_observations_unique": 23066,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.144
},
{
"type": "Completeness",
"value": 95.300
},
{
"type": "Redundancy",
"value": 4.600
}
]
},
{
"resolution_limits": [2.650,2.320],
"number_observations_unique": 22882,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.132
},
{
"type": "Completeness",
"value": 93.900
},
{
"type": "Redundancy",
"value": 4.900
}
]
},
{
"resolution_limits": [3.340,2.650],
"number_observations_unique": 23117,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.118
},
{
"type": "Completeness",
"value": 94.600
},
{
"type": "Redundancy",
"value": 5.700
}
]
},
{
"resolution_limits": [50.000,3.340],
"number_observations_unique": 24131,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.107
},
{
"type": "Completeness",
"value": 97.200
},
{
"type": "Redundancy",
"value": 6.200
}
]
}
]
}