Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "17323b11643aac16c142c739e6720220",
"space_group_name": "P 21 21 2",
"unit_cell": {
"a": 63.451,
"b": 93.137,
"c": 112.569,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30.000,2.000],
"number_observations_unique": 44865,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "I/SigI",
"value": 19.800
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 5.500
}
]
},
"refln_shells": [
{
"resolution_limits": [2.07,2.00],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.337
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 5.60
}
]
},
{
"resolution_limits": [2.15,2.07],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.252
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 5.60
}
]
},
{
"resolution_limits": [2.25,2.15],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.200
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 5.70
}
]
},
{
"resolution_limits": [2.37,2.25],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.156
},
{
"type": "Completeness",
"value": 99.90
},
{
"type": "Redundancy",
"value": 5.70
}
]
},
{
"resolution_limits": [2.52,2.37],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.113
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 5.70
}
]
},
{
"resolution_limits": [2.71,2.52],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.088
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 5.70
}
]
},
{
"resolution_limits": [2.99,2.71],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 5.60
}
]
},
{
"resolution_limits": [3.42,2.99],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "Completeness",
"value": 98.90
},
{
"type": "Redundancy",
"value": 5.40
}
]
},
{
"resolution_limits": [4.31,3.42],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.045
},
{
"type": "Completeness",
"value": 98.70
},
{
"type": "Redundancy",
"value": 5.20
}
]
},
{
"resolution_limits": [30.00,4.31],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "Completeness",
"value": 93.90
},
{
"type": "Redundancy",
"value": 4.90
}
]
}
]
}