Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "81b4c571d036b0eed0542de565cfdbdb",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 53.555,
"b": 65.210,
"c": 69.673,
"alpha": 90.00,
"beta": 100.17,
"gamma": 90.00
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [65.21,1.80],
"number_observations_unique": 43655,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.042
},
{
"type": "R(pim)",
"value": 0.009
},
{
"type": "I/SigI",
"value": 30.0
},
{
"type": "Completeness",
"value": 99.42
},
{
"type": "Redundancy",
"value": 20.25
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.83,1.80],
"number_observations_unique": 2165,
"quality_factors": [
{
"type": "R(meas)",
"value": 1.238
},
{
"type": "R(pim)",
"value": 0.269
},
{
"type": "I/SigI",
"value": 0.6
},
{
"type": "Completeness",
"value": 98.77
},
{
"type": "CC(1/2)",
"value": 0.920
}
]
},
{
"resolution_limits": [1.86,1.83],
"number_observations_unique": 2147,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.960
},
{
"type": "R(pim)",
"value": 0.209
},
{
"type": "I/SigI",
"value": 0.7
},
{
"type": "Completeness",
"value": 98.76
},
{
"type": "CC(1/2)",
"value": 0.947
}
]
},
{
"resolution_limits": [1.90,1.86],
"number_observations_unique": 2148,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.704
},
{
"type": "R(pim)",
"value": 0.153
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Completeness",
"value": 98.71
},
{
"type": "CC(1/2)",
"value": 0.969
}
]
},
{
"resolution_limits": [1.94,1.90],
"number_observations_unique": 2153,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.583
},
{
"type": "R(pim)",
"value": 0.128
},
{
"type": "I/SigI",
"value": 1.3
},
{
"type": "Completeness",
"value": 98.99
},
{
"type": "CC(1/2)",
"value": 0.968
}
]
},
{
"resolution_limits": [1.98,1.94],
"number_observations_unique": 2169,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.419
},
{
"type": "R(pim)",
"value": 0.093
},
{
"type": "I/SigI",
"value": 1.9
},
{
"type": "Completeness",
"value": 98.95
},
{
"type": "CC(1/2)",
"value": 0.984
}
]
},
{
"resolution_limits": [2.03,1.98],
"number_observations_unique": 2168,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.330
},
{
"type": "R(pim)",
"value": 0.074
},
{
"type": "I/SigI",
"value": 2.4
},
{
"type": "Completeness",
"value": 99.13
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
},
{
"resolution_limits": [2.08,2.03],
"number_observations_unique": 2137,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.281
},
{
"type": "R(pim)",
"value": 0.063
},
{
"type": "I/SigI",
"value": 3.1
},
{
"type": "Completeness",
"value": 99.16
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
{
"resolution_limits": [2.13,2.08],
"number_observations_unique": 2192,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.227
},
{
"type": "R(pim)",
"value": 0.052
},
{
"type": "I/SigI",
"value": 3.9
},
{
"type": "Completeness",
"value": 99.14
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
{
"resolution_limits": [2.20,2.13],
"number_observations_unique": 2160,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.186
},
{
"type": "R(pim)",
"value": 0.042
},
{
"type": "I/SigI",
"value": 5.4
},
{
"type": "Completeness",
"value": 99.31
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
{
"resolution_limits": [2.27,2.20],
"number_observations_unique": 2180,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.159
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 7.3
},
{
"type": "Completeness",
"value": 99.45
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
{
"resolution_limits": [2.35,2.27],
"number_observations_unique": 2200,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.137
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 9.1
},
{
"type": "Completeness",
"value": 99.55
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
{
"resolution_limits": [2.44,2.35],
"number_observations_unique": 2172,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.115
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 12.1
},
{
"type": "Completeness",
"value": 99.54
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
{
"resolution_limits": [2.55,2.44],
"number_observations_unique": 2180,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.094
},
{
"type": "R(pim)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 15.8
},
{
"type": "Completeness",
"value": 99.59
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [2.69,2.55],
"number_observations_unique": 2182,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.082
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 20.9
},
{
"type": "Completeness",
"value": 99.77
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [2.86,2.69],
"number_observations_unique": 2189,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.067
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 28.4
},
{
"type": "Completeness",
"value": 99.73
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [3.08,2.86],
"number_observations_unique": 2192,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.053
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 40.7
},
{
"type": "Completeness",
"value": 99.82
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [3.39,3.08],
"number_observations_unique": 2211,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.044
},
{
"type": "R(pim)",
"value": 0.10
},
{
"type": "I/SigI",
"value": 62.5
},
{
"type": "Completeness",
"value": 99.95
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [3.88,3.39],
"number_observations_unique": 2207,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.037
},
{
"type": "R(pim)",
"value": 0.008
},
{
"type": "I/SigI",
"value": 98.7
},
{
"type": "Completeness",
"value": 100
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
{
"resolution_limits": [4.89,3.88],
"number_observations_unique": 2223,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.031
},
{
"type": "R(pim)",
"value": 0.007
},
{
"type": "I/SigI",
"value": 130.1
},
{
"type": "Completeness",
"value": 100
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
{
"resolution_limits": [65.25,4.89],
"number_observations_unique": 2280,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.031
},
{
"type": "R(pim)",
"value": 0.007
},
{
"type": "I/SigI",
"value": 142.4
},
{
"type": "Completeness",
"value": 100
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}