Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "59707300f04103227459ee70117d3ece",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 94.7,
"b": 38.7,
"c": 97.8,
"alpha": 90.0,
"beta": 118.9,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.000,1.900],
"number_observations": 163079,
"number_observations_unique": 49319,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.062
},
{
"type": "R(meas)",
"value": 0.074
},
{
"type": "I/SigI",
"value": 13.200
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 3.307
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.000,1.900],
"number_observations_unique": 6946,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.394
},
{
"type": "R(meas)",
"value": 0.473
},
{
"type": "I/SigI",
"value": 3.490
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 3.242
},
{
"type": "CC(1/2)",
"value": 0.846
}
]
},
{
"resolution_limits": [2.500,2.000],
"number_observations_unique": 20523,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.180
},
{
"type": "R(meas)",
"value": 0.214
},
{
"type": "I/SigI",
"value": 6.840
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 3.335
},
{
"type": "CC(1/2)",
"value": 0.974
}
]
},
{
"resolution_limits": [3.000,2.500],
"number_observations_unique": 9126,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "R(meas)",
"value": 0.096
},
{
"type": "I/SigI",
"value": 13.470
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 3.397
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
{
"resolution_limits": [4.000,3.000],
"number_observations_unique": 7245,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "R(meas)",
"value": 0.045
},
{
"type": "I/SigI",
"value": 24.750
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 3.167
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [6.000,4.000],
"number_observations_unique": 3799,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.025
},
{
"type": "R(meas)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 33.610
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 3.335
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [10.000,6.000],
"number_observations_unique": 1295,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.023
},
{
"type": "R(meas)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 33.660
},
{
"type": "Completeness",
"value": 98.200
},
{
"type": "Redundancy",
"value": 3.431
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [20.000,10.000],
"number_observations_unique": 336,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.019
},
{
"type": "R(meas)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 34.640
},
{
"type": "Completeness",
"value": 97.700
},
{
"type": "Redundancy",
"value": 2.893
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [50.000,20.000],
"number_observations_unique": 49,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.013
},
{
"type": "R(meas)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 25.700
},
{
"type": "Completeness",
"value": 96.100
},
{
"type": "Redundancy",
"value": 1.878
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}