Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4d12718a21e902c75a7ab23b24163704",
"space_group_name": "H 3 2",
"unit_cell": {
"a": 116.961,
"b": 116.961,
"c": 82.544,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.28270],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.2210,2.900],
"number_observations": 47129,
"number_observations_unique": 9325,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.074
},
{
"type": "R(meas)",
"value": 0.083
},
{
"type": "I/SigI",
"value": 10.200
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 4.800
}
]
},
"refln_shells": [
{
"resolution_limits": [3.000,2.900],
"number_observations": 4846,
"number_observations_unique": 955,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.390
},
{
"type": "R(meas)",
"value": 0.440
},
{
"type": "I/SigI",
"value": 2.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 4.730
}
]
},
{
"resolution_limits": [3.120,3.000],
"number_observations": 4630,
"number_observations_unique": 914,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.304
},
{
"type": "R(meas)",
"value": 0.341
},
{
"type": "I/SigI",
"value": 3.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 4.770
}
]
},
{
"resolution_limits": [3.270,3.120],
"number_observations": 4718,
"number_observations_unique": 930,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.288
},
{
"type": "R(meas)",
"value": 0.323
},
{
"type": "I/SigI",
"value": 4.300
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 4.760
}
]
},
{
"resolution_limits": [3.440,3.270],
"number_observations": 4763,
"number_observations_unique": 939,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.193
},
{
"type": "R(meas)",
"value": 0.217
},
{
"type": "I/SigI",
"value": 5.500
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 4.810
}
]
},
{
"resolution_limits": [3.650,3.440],
"number_observations": 4695,
"number_observations_unique": 934,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.144
},
{
"type": "R(meas)",
"value": 0.162
},
{
"type": "I/SigI",
"value": 7.100
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 4.780
}
]
},
{
"resolution_limits": [3.940,3.650],
"number_observations": 4659,
"number_observations_unique": 926,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.101
},
{
"type": "R(meas)",
"value": 0.113
},
{
"type": "I/SigI",
"value": 9.700
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 4.800
}
]
},
{
"resolution_limits": [4.330,3.940],
"number_observations": 4730,
"number_observations_unique": 933,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.067
},
{
"type": "R(meas)",
"value": 0.074
},
{
"type": "I/SigI",
"value": 13.700
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 4.900
}
]
},
{
"resolution_limits": [4.960,4.330],
"number_observations": 4672,
"number_observations_unique": 924,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "R(meas)",
"value": 0.061
},
{
"type": "I/SigI",
"value": 17.000
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 4.900
}
]
},
{
"resolution_limits": [6.240,4.960],
"number_observations": 4732,
"number_observations_unique": 939,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.061
},
{
"type": "R(meas)",
"value": 0.068
},
{
"type": "I/SigI",
"value": 16.800
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 4.880
}
]
},
{
"resolution_limits": [38.210,6.240],
"number_observations": 4684,
"number_observations_unique": 931,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "R(meas)",
"value": 0.059
},
{
"type": "I/SigI",
"value": 21.300
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 4.680
}
]
}
]
}