Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a18f09a8b28dadd4a823b3efe245cdf2",
"space_group_name": "P 63",
"unit_cell": {
"a": 131.39,
"b": 131.39,
"c": 315.34,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,2.37],
"number_observations_unique": 50660,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.149
},
{
"type": "R(meas)",
"value": 0.174
},
{
"type": "R(pim)",
"value": 0.087
},
{
"type": "I/SigI",
"value": 5.800
},
{
"type": "Completeness",
"value": 42.300
},
{
"type": "Redundancy",
"value": 3.300
}
]
},
"refln_shells": [
{
"resolution_limits": [2.490,2.400],
"number_observations_unique": 269,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.426
},
{
"type": "R(meas)",
"value": 0.542
},
{
"type": "R(pim)",
"value": 0.331
},
{
"type": "Completeness",
"value": 2.300
},
{
"type": "Redundancy",
"value": 1.100
},
{
"type": "CC(1/2)",
"value": 0.859
}
]
},
{
"resolution_limits": [2.590,2.490],
"number_observations_unique": 896,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.043
},
{
"type": "R(meas)",
"value": 1.398
},
{
"type": "R(pim)",
"value": 0.922
},
{
"type": "Completeness",
"value": 7.500
},
{
"type": "Redundancy",
"value": 1.000
},
{
"type": "CC(1/2)",
"value": 0.142
}
]
},
{
"resolution_limits": [2.700,2.590],
"number_observations_unique": 1354,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.710
},
{
"type": "R(meas)",
"value": 0.911
},
{
"type": "R(pim)",
"value": 0.562
},
{
"type": "Completeness",
"value": 11.400
},
{
"type": "Redundancy",
"value": 1.200
},
{
"type": "CC(1/2)",
"value": 0.142
}
]
},
{
"resolution_limits": [2.850,2.700],
"number_observations_unique": 1893,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.568
},
{
"type": "R(meas)",
"value": 0.695
},
{
"type": "R(pim)",
"value": 0.392
},
{
"type": "Completeness",
"value": 15.800
},
{
"type": "Redundancy",
"value": 1.500
},
{
"type": "CC(1/2)",
"value": 0.458
}
]
},
{
"resolution_limits": [3.020,2.850],
"number_observations_unique": 2363,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.475
},
{
"type": "R(meas)",
"value": 0.562
},
{
"type": "R(pim)",
"value": 0.294
},
{
"type": "Completeness",
"value": 19.800
},
{
"type": "Redundancy",
"value": 2.100
},
{
"type": "CC(1/2)",
"value": 0.618
}
]
},
{
"resolution_limits": [3.260,3.020],
"number_observations_unique": 3964,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.439
},
{
"type": "R(meas)",
"value": 0.511
},
{
"type": "R(pim)",
"value": 0.256
},
{
"type": "Completeness",
"value": 33.200
},
{
"type": "Redundancy",
"value": 2.400
},
{
"type": "CC(1/2)",
"value": 0.830
}
]
},
{
"resolution_limits": [3.580,3.260],
"number_observations_unique": 6564,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.380
},
{
"type": "R(meas)",
"value": 0.441
},
{
"type": "R(pim)",
"value": 0.218
},
{
"type": "Completeness",
"value": 54.800
},
{
"type": "Redundancy",
"value": 2.800
},
{
"type": "CC(1/2)",
"value": 0.909
}
]
},
{
"resolution_limits": [4.100,3.580],
"number_observations_unique": 9901,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.215
},
{
"type": "R(meas)",
"value": 0.248
},
{
"type": "R(pim)",
"value": 0.120
},
{
"type": "Completeness",
"value": 82.600
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 0.954
}
]
},
{
"resolution_limits": [5.170,4.100],
"number_observations_unique": 11676,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.093
},
{
"type": "R(meas)",
"value": 0.110
},
{
"type": "R(pim)",
"value": 0.057
},
{
"type": "Completeness",
"value": 97.400
},
{
"type": "Redundancy",
"value": 4.300
},
{
"type": "CC(1/2)",
"value": 0.983
}
]
},
{
"resolution_limits": [50.000,5.170],
"number_observations_unique": 11780,
"quality_factors": [
{
"type": "Completeness",
"value": 97.500
},
{
"type": "Redundancy",
"value": 4.100
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
}
]
}