Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6bfffed3d08ee4631284eabd056f7d7f",
"space_group_name": "P 1",
"unit_cell": {
"a": 47.268,
"b": 49.136,
"c": 84.725,
"alpha": 71.90,
"beta": 81.58,
"gamma": 70.26
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.0,2.528],
"number_observations_unique": 22331,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.093
},
{
"type": "I/SigI",
"value": 6.7
},
{
"type": "Completeness",
"value": 98.6
},
{
"type": "Redundancy",
"value": 2.2
}
]
},
"refln_shells": [
{
"resolution_limits": [2.620,2.528],
"number_observations_unique": 2242,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.315
},
{
"type": "Completeness",
"value": 97.9
},
{
"type": "Redundancy",
"value": 2.1
}
]
},
{
"resolution_limits": [2.730,2.620],
"number_observations_unique": 2212,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.263
},
{
"type": "Completeness",
"value": 97.8
},
{
"type": "Redundancy",
"value": 2.2
}
]
},
{
"resolution_limits": [2.850,2.730],
"number_observations_unique": 2204,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.212
},
{
"type": "Completeness",
"value": 98.4
},
{
"type": "Redundancy",
"value": 2.2
}
]
},
{
"resolution_limits": [3.000,2.850],
"number_observations_unique": 2236,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.169
},
{
"type": "Completeness",
"value": 98.4
},
{
"type": "Redundancy",
"value": 2.2
}
]
},
{
"resolution_limits": [3.190,3.000],
"number_observations_unique": 2214,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.141
},
{
"type": "Completeness",
"value": 98.4
},
{
"type": "Redundancy",
"value": 2.2
}
]
},
{
"resolution_limits": [3.430,3.190],
"number_observations_unique": 2236,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.108
},
{
"type": "Completeness",
"value": 98.5
},
{
"type": "Redundancy",
"value": 2.2
}
]
},
{
"resolution_limits": [3.780,3.430],
"number_observations_unique": 2256,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.075
},
{
"type": "Completeness",
"value": 98.8
},
{
"type": "Redundancy",
"value": 2.2
}
]
},
{
"resolution_limits": [4.330,3.780],
"number_observations_unique": 2238,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "Completeness",
"value": 99.0
},
{
"type": "Redundancy",
"value": 2.2
}
]
},
{
"resolution_limits": [5.450,4.330],
"number_observations_unique": 2245,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "Completeness",
"value": 99.2
},
{
"type": "Redundancy",
"value": 2.1
}
]
},
{
"resolution_limits": [50.000,5.450],
"number_observations_unique": 2248,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.051
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 2.2
}
]
}
]
}