Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "fde6a119e00588ed2594611faec1e6f2",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 55.921,
"b": 142.342,
"c": 62.434,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30.000,1.900],
"number_observations_unique": 19738,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.138
},
{
"type": "I/SigI",
"value": 6.400
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 4.800
}
]
},
"refln_shells": [
{
"resolution_limits": [1.97,1.90],
"number_observations_unique": 1906,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.901
},
{
"type": "Completeness",
"value": 98.10
},
{
"type": "Redundancy",
"value": 4.20
}
]
},
{
"resolution_limits": [2.05,1.97],
"number_observations_unique": 1929,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.749
},
{
"type": "Completeness",
"value": 98.80
},
{
"type": "Redundancy",
"value": 4.50
}
]
},
{
"resolution_limits": [2.14,2.05],
"number_observations_unique": 1957,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.576
},
{
"type": "Completeness",
"value": 98.80
},
{
"type": "Redundancy",
"value": 4.80
}
]
},
{
"resolution_limits": [2.25,2.14],
"number_observations_unique": 1945,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.441
},
{
"type": "Completeness",
"value": 99.10
},
{
"type": "Redundancy",
"value": 4.80
}
]
},
{
"resolution_limits": [2.39,2.25],
"number_observations_unique": 1965,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.370
},
{
"type": "Completeness",
"value": 99.50
},
{
"type": "Redundancy",
"value": 4.80
}
]
},
{
"resolution_limits": [2.58,2.39],
"number_observations_unique": 1955,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.271
},
{
"type": "Completeness",
"value": 99.60
},
{
"type": "Redundancy",
"value": 4.90
}
]
},
{
"resolution_limits": [2.84,2.58],
"number_observations_unique": 1995,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.207
},
{
"type": "Completeness",
"value": 99.80
},
{
"type": "Redundancy",
"value": 4.90
}
]
},
{
"resolution_limits": [3.25,2.84],
"number_observations_unique": 2000,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.136
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 5.00
}
]
},
{
"resolution_limits": [4.09,3.25],
"number_observations_unique": 2002,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.092
},
{
"type": "Completeness",
"value": 99.40
},
{
"type": "Redundancy",
"value": 5.00
}
]
},
{
"resolution_limits": [30.00,4.09],
"number_observations_unique": 2084,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.061
},
{
"type": "Completeness",
"value": 97.90
},
{
"type": "Redundancy",
"value": 5.00
}
]
}
]
}