Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9ffe3193471264c4339226d7faa63bdb",
"space_group_name": "P 61 2 2",
"unit_cell": {
"a": 92.011,
"b": 92.011,
"c": 178.242,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.54000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.710,1.800],
"number_observations": 740239,
"number_observations_unique": 41844,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.061
},
{
"type": "R(meas)",
"value": 0.062
},
{
"type": "I/SigI",
"value": 23.900
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 17.560
}
]
},
"refln_shells": [
{
"resolution_limits": [1.860,1.800],
"number_observations": 27038,
"number_observations_unique": 3898,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.291
},
{
"type": "R(meas)",
"value": 0.313
},
{
"type": "I/SigI",
"value": 5.100
},
{
"type": "Completeness",
"value": 94.600
},
{
"type": "Redundancy",
"value": 6.930
}
]
},
{
"resolution_limits": [1.940,1.860],
"number_observations": 41363,
"number_observations_unique": 4092,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.242
},
{
"type": "R(meas)",
"value": 0.255
},
{
"type": "I/SigI",
"value": 7.200
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 10.080
}
]
},
{
"resolution_limits": [2.030,1.940],
"number_observations": 66793,
"number_observations_unique": 4146,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.192
},
{
"type": "R(meas)",
"value": 0.199
},
{
"type": "I/SigI",
"value": 10.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 15.910
}
]
},
{
"resolution_limits": [2.130,2.030],
"number_observations": 85692,
"number_observations_unique": 4148,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.147
},
{
"type": "R(meas)",
"value": 0.151
},
{
"type": "I/SigI",
"value": 14.100
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 20.360
}
]
},
{
"resolution_limits": [2.270,2.130],
"number_observations": 85197,
"number_observations_unique": 4132,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.116
},
{
"type": "R(meas)",
"value": 0.119
},
{
"type": "I/SigI",
"value": 17.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 20.430
}
]
},
{
"resolution_limits": [2.440,2.270],
"number_observations": 85808,
"number_observations_unique": 4170,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.097
},
{
"type": "R(meas)",
"value": 0.100
},
{
"type": "I/SigI",
"value": 20.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 20.480
}
]
},
{
"resolution_limits": [2.690,2.440],
"number_observations": 86157,
"number_observations_unique": 4196,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "R(meas)",
"value": 0.084
},
{
"type": "I/SigI",
"value": 24.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 20.440
}
]
},
{
"resolution_limits": [3.080,2.690],
"number_observations": 87028,
"number_observations_unique": 4244,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.067
},
{
"type": "R(meas)",
"value": 0.069
},
{
"type": "I/SigI",
"value": 27.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 20.400
}
]
},
{
"resolution_limits": [3.880,3.080],
"number_observations": 87447,
"number_observations_unique": 4284,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "R(meas)",
"value": 0.058
},
{
"type": "I/SigI",
"value": 37.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 20.280
}
]
},
{
"resolution_limits": [29.710,3.880],
"number_observations": 87716,
"number_observations_unique": 4534,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "R(meas)",
"value": 0.047
},
{
"type": "I/SigI",
"value": 50.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.190
}
]
}
]
}