Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "bc76813b17da6fcabe01ed2a9cc06be4",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 46.053,
"b": 9.561,
"c": 20.871,
"alpha": 90.00,
"beta": 97.43,
"gamma": 90.00
},
"wavelengths": [0.97920],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [90.000,1.800],
"number_observations_unique": 849,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.161
},
{
"type": "I/SigI",
"value": 4.500
},
{
"type": "Completeness",
"value": 90.900
},
{
"type": "Redundancy",
"value": 3.200
}
]
},
"refln_shells": [
{
"resolution_limits": [1.940,1.800],
"number_observations_unique": 155,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.480
},
{
"type": "Completeness",
"value": 81.200
},
{
"type": "Redundancy",
"value": 2.400
}
]
},
{
"resolution_limits": [2.130,1.940],
"number_observations_unique": 162,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.373
},
{
"type": "Completeness",
"value": 97.000
},
{
"type": "Redundancy",
"value": 3.200
}
]
},
{
"resolution_limits": [2.440,2.130],
"number_observations_unique": 173,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.487
},
{
"type": "Completeness",
"value": 93.000
},
{
"type": "Redundancy",
"value": 3.400
}
]
},
{
"resolution_limits": [3.080,2.440],
"number_observations_unique": 179,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.299
},
{
"type": "Completeness",
"value": 96.200
},
{
"type": "Redundancy",
"value": 3.500
}
]
},
{
"resolution_limits": [90.000,3.080],
"number_observations_unique": 180,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.122
},
{
"type": "Completeness",
"value": 88.200
},
{
"type": "Redundancy",
"value": 3.400
}
]
}
]
}