Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "41a5386150229c17a42cf52a8b820663",
"space_group_name": "P 21 21 2",
"unit_cell": {
"a": 83.372,
"b": 193.904,
"c": 67.379,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.54180,0.97944],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [20,2.1],
"number_observations_unique": 64298,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.086
},
{
"type": "I/SigI",
"value": 32.8
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 11.3
}
]
},
"refln_shells": [
{
"resolution_limits": [2.17,2.10],
"number_observations_unique": 6333,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.269
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 11.2
}
]
},
{
"resolution_limits": [2.26,2.17],
"number_observations_unique": 6364,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.221
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 11.2
}
]
},
{
"resolution_limits": [2.36,2.26],
"number_observations_unique": 6349,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.184
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 11.3
}
]
},
{
"resolution_limits": [2.49,2.36],
"number_observations_unique": 6410,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.155
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 11.3
}
]
},
{
"resolution_limits": [2.64,2.49],
"number_observations_unique": 6356,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.132
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 11.3
}
]
},
{
"resolution_limits": [2.85,2.64],
"number_observations_unique": 6423,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.105
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 11.4
}
]
},
{
"resolution_limits": [3.13,2.85],
"number_observations_unique": 6422,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.083
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 11.4
}
]
},
{
"resolution_limits": [3.59,3.13],
"number_observations_unique": 6488,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.088
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 11.4
}
]
},
{
"resolution_limits": [4.51,3.59],
"number_observations_unique": 6511,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 11.4
}
]
},
{
"resolution_limits": [20,4.51],
"number_observations_unique": 6642,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "Completeness",
"value": 97.9
},
{
"type": "Redundancy",
"value": 11.2
}
]
}
]
}