Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d8f1bcab7bdf1e3bb09e2e40a8cbb01d",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 121.144,
"b": 61.567,
"c": 80.472,
"alpha": 90.00,
"beta": 117.27,
"gamma": 90.00
},
"wavelengths": [0.97980],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,2.000],
"number_observations_unique": 34385,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.100
},
{
"type": "I/SigI",
"value": 10.500
},
{
"type": "Completeness",
"value": 96.100
},
{
"type": "Redundancy",
"value": 4.900
}
]
},
"refln_shells": [
{
"resolution_limits": [2.03,2.00],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.711
},
{
"type": "Completeness",
"value": 70.90
},
{
"type": "Redundancy",
"value": 3.80
}
]
},
{
"resolution_limits": [2.07,2.03],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.748
},
{
"type": "Completeness",
"value": 78.80
},
{
"type": "Redundancy",
"value": 3.90
}
]
},
{
"resolution_limits": [2.11,2.07],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.716
},
{
"type": "Completeness",
"value": 93.40
},
{
"type": "Redundancy",
"value": 4.00
}
]
},
{
"resolution_limits": [2.15,2.11],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.677
},
{
"type": "Completeness",
"value": 97.80
},
{
"type": "Redundancy",
"value": 4.40
}
]
},
{
"resolution_limits": [2.20,2.15],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.556
},
{
"type": "Completeness",
"value": 98.20
},
{
"type": "Redundancy",
"value": 4.90
}
]
},
{
"resolution_limits": [2.25,2.20],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.537
},
{
"type": "Completeness",
"value": 98.10
},
{
"type": "Redundancy",
"value": 5.00
}
]
},
{
"resolution_limits": [2.31,2.25],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.500
},
{
"type": "Completeness",
"value": 98.30
},
{
"type": "Redundancy",
"value": 5.10
}
]
},
{
"resolution_limits": [2.37,2.31],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.425
},
{
"type": "Completeness",
"value": 98.50
},
{
"type": "Redundancy",
"value": 5.20
}
]
},
{
"resolution_limits": [2.44,2.37],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.429
},
{
"type": "Completeness",
"value": 98.40
},
{
"type": "Redundancy",
"value": 5.20
}
]
},
{
"resolution_limits": [2.52,2.44],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.343
},
{
"type": "Completeness",
"value": 98.60
},
{
"type": "Redundancy",
"value": 5.20
}
]
},
{
"resolution_limits": [2.61,2.52],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.281
},
{
"type": "Completeness",
"value": 98.70
},
{
"type": "Redundancy",
"value": 5.20
}
]
},
{
"resolution_limits": [2.71,2.61],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.230
},
{
"type": "Completeness",
"value": 98.80
},
{
"type": "Redundancy",
"value": 5.20
}
]
},
{
"resolution_limits": [2.84,2.71],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.194
},
{
"type": "Completeness",
"value": 99.00
},
{
"type": "Redundancy",
"value": 5.20
}
]
},
{
"resolution_limits": [2.99,2.84],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.147
},
{
"type": "Completeness",
"value": 98.90
},
{
"type": "Redundancy",
"value": 5.20
}
]
},
{
"resolution_limits": [3.17,2.99],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.114
},
{
"type": "Completeness",
"value": 99.20
},
{
"type": "Redundancy",
"value": 5.20
}
]
},
{
"resolution_limits": [3.42,3.17],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "Completeness",
"value": 99.20
},
{
"type": "Redundancy",
"value": 5.10
}
]
},
{
"resolution_limits": [3.76,3.42],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "Completeness",
"value": 99.30
},
{
"type": "Redundancy",
"value": 5.10
}
]
},
{
"resolution_limits": [4.31,3.76],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.058
},
{
"type": "Completeness",
"value": 99.50
},
{
"type": "Redundancy",
"value": 5.10
}
]
},
{
"resolution_limits": [5.43,4.31],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "Completeness",
"value": 99.60
},
{
"type": "Redundancy",
"value": 5.00
}
]
},
{
"resolution_limits": [50.00,5.43],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.064
},
{
"type": "Completeness",
"value": 97.80
},
{
"type": "Redundancy",
"value": 4.80
}
]
}
]
}