Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d545eee96425ffaca3da1b4994cf5441",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 75.58,
"b": 75.58,
"c": 198.87,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91837,0.97876,0.97904],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [28.41,2.10],
"number_observations_unique": 34611,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.135
},
{
"type": "I/SigI",
"value": 8.690
},
{
"type": "Completeness",
"value": 99.80
}
]
},
"refln_shells": [
{
"resolution_limits": [2.17,2.10],
"number_observations": 20733,
"number_observations_unique": 5368,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.534
},
{
"type": "I/SigI",
"value": 2.54
},
{
"type": "Completeness",
"value": 98.30
}
]
},
{
"resolution_limits": [2.26,2.17],
"number_observations": 23739,
"number_observations_unique": 6124,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.42
},
{
"type": "I/SigI",
"value": 3.4
},
{
"type": "Completeness",
"value": 92.00
}
]
},
{
"resolution_limits": [2.36,2.26],
"number_observations": 22642,
"number_observations_unique": 5820,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.383
},
{
"type": "I/SigI",
"value": 3.7
},
{
"type": "Completeness",
"value": 92.30
}
]
},
{
"resolution_limits": [2.49,2.36],
"number_observations": 24356,
"number_observations_unique": 6264,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.347
},
{
"type": "I/SigI",
"value": 4.1
},
{
"type": "Completeness",
"value": 93.10
}
]
},
{
"resolution_limits": [2.64,2.49],
"number_observations": 22764,
"number_observations_unique": 5841,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.288
},
{
"type": "I/SigI",
"value": 4.9
},
{
"type": "Completeness",
"value": 94.10
}
]
},
{
"resolution_limits": [2.85,2.64],
"number_observations": 24664,
"number_observations_unique": 6333,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.22
},
{
"type": "I/SigI",
"value": 6.3
},
{
"type": "Completeness",
"value": 95.70
}
]
},
{
"resolution_limits": [3.13,2.85],
"number_observations": 24030,
"number_observations_unique": 6165,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.154
},
{
"type": "I/SigI",
"value": 8.9
},
{
"type": "Completeness",
"value": 97.30
}
]
},
{
"resolution_limits": [3.59,3.13],
"number_observations": 25059,
"number_observations_unique": 6441,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.097
},
{
"type": "I/SigI",
"value": 13.7
},
{
"type": "Completeness",
"value": 98.20
}
]
},
{
"resolution_limits": [28.41,3.59],
"number_observations": 24744,
"number_observations_unique": 6331,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.058
},
{
"type": "I/SigI",
"value": 19.8
},
{
"type": "Completeness",
"value": 99.20
}
]
}
]
}