Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "25899547abfe91539d2ff54f1662c39a",
"space_group_name": "P 61",
"unit_cell": {
"a": 285.826,
"b": 285.826,
"c": 62.248,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.12710],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [250.0,3.238],
"number_observations_unique": 47509,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.207
},
{
"type": "I/SigI",
"value": 5.6
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 6.5
}
]
},
"refln_shells": [
{
"resolution_limits": [3.370,3.238],
"number_observations_unique": 4584,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.750
},
{
"type": "Completeness",
"value": 97.8
},
{
"type": "Redundancy",
"value": 4.3
}
]
},
{
"resolution_limits": [3.500,3.370],
"number_observations_unique": 4729,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.653
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 5.3
}
]
},
{
"resolution_limits": [3.660,3.500],
"number_observations_unique": 4736,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.516
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 6.0
}
]
},
{
"resolution_limits": [3.850,3.660],
"number_observations_unique": 4708,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.442
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 6.5
}
]
},
{
"resolution_limits": [4.090,3.850],
"number_observations_unique": 4757,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.340
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 6.8
}
]
},
{
"resolution_limits": [4.410,4.090],
"number_observations_unique": 4747,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.204
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 6.9
}
]
},
{
"resolution_limits": [4.850,4.410],
"number_observations_unique": 4769,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.162
},
{
"type": "Completeness",
"value": 99.5
},
{
"type": "Redundancy",
"value": 6.9
}
]
},
{
"resolution_limits": [5.560,4.850],
"number_observations_unique": 4755,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.136
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 7.1
}
]
},
{
"resolution_limits": [7.000,5.560],
"number_observations_unique": 4806,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.125
},
{
"type": "Completeness",
"value": 99.2
},
{
"type": "Redundancy",
"value": 7.4
}
]
},
{
"resolution_limits": [50.000,7.000],
"number_observations_unique": 4918,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "Completeness",
"value": 98.9
},
{
"type": "Redundancy",
"value": 7.3
}
]
}
]
}