Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f4e773bd342e210785569651c26671f2",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 61.90,
"b": 65.70,
"c": 93.02,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.79272],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.990,1.750],
"number_observations": 442254,
"number_observations_unique": 38947,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.158
},
{
"type": "R(meas)",
"value": 0.165
},
{
"type": "I/SigI",
"value": 14.540
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.355
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.900,1.750],
"number_observations_unique": 8372,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.842
},
{
"type": "R(meas)",
"value": 0.881
},
{
"type": "I/SigI",
"value": 3.380
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.460
},
{
"type": "CC(1/2)",
"value": 0.850
}
]
},
{
"resolution_limits": [2.000,1.900],
"number_observations_unique": 4309,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.503
},
{
"type": "R(meas)",
"value": 0.526
},
{
"type": "I/SigI",
"value": 5.620
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.395
},
{
"type": "CC(1/2)",
"value": 0.940
}
]
},
{
"resolution_limits": [3.000,2.000],
"number_observations_unique": 18262,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.219
},
{
"type": "R(meas)",
"value": 0.230
},
{
"type": "I/SigI",
"value": 12.030
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.425
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
},
{
"resolution_limits": [4.000,3.000],
"number_observations_unique": 4537,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "R(meas)",
"value": 0.073
},
{
"type": "I/SigI",
"value": 31.470
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.251
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [5.000,4.000],
"number_observations_unique": 1649,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "R(meas)",
"value": 0.046
},
{
"type": "I/SigI",
"value": 47.440
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 11.144
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [10.000,5.000],
"number_observations_unique": 1570,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "R(meas)",
"value": 0.057
},
{
"type": "I/SigI",
"value": 37.470
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.734
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [50.000,10.000],
"number_observations_unique": 248,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.027
},
{
"type": "R(meas)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 57.380
},
{
"type": "Completeness",
"value": 97.600
},
{
"type": "Redundancy",
"value": 9.230
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
{
"resolution_limits": [1.90,1.75],
"number_observations_unique": 8372,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.88
},
{
"type": "I/SigI",
"value": 3.38
},
{
"type": "Completeness",
"value": 100
},
{
"type": "CC(1/2)",
"value": 0.85
}
]
}
]
}