Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "687c5e31060c8de608582577bfee9d3d",
"space_group_name": "P 1",
"unit_cell": {
"a": 75.239,
"b": 99.640,
"c": 100.261,
"alpha": 103.66,
"beta": 105.23,
"gamma": 102.26
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,2.300],
"number_observations_unique": 113899,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.104
},
{
"type": "I/SigI",
"value": 16.202
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 5.000
}
]
},
"refln_shells": [
{
"resolution_limits": [2.38,2.30],
"number_observations_unique": 11331,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.587
},
{
"type": "Completeness",
"value": 97.80
},
{
"type": "Redundancy",
"value": 5.00
}
]
},
{
"resolution_limits": [2.48,2.38],
"number_observations_unique": 11259,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.483
},
{
"type": "Completeness",
"value": 97.80
},
{
"type": "Redundancy",
"value": 5.00
}
]
},
{
"resolution_limits": [2.59,2.48],
"number_observations_unique": 11366,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.369
},
{
"type": "Completeness",
"value": 98.10
},
{
"type": "Redundancy",
"value": 5.00
}
]
},
{
"resolution_limits": [2.73,2.59],
"number_observations_unique": 11315,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.289
},
{
"type": "Completeness",
"value": 98.20
},
{
"type": "Redundancy",
"value": 5.00
}
]
},
{
"resolution_limits": [2.90,2.73],
"number_observations_unique": 11415,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.207
},
{
"type": "Completeness",
"value": 98.50
},
{
"type": "Redundancy",
"value": 5.00
}
]
},
{
"resolution_limits": [3.12,2.90],
"number_observations_unique": 11387,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.146
},
{
"type": "Completeness",
"value": 98.60
},
{
"type": "Redundancy",
"value": 5.00
}
]
},
{
"resolution_limits": [3.44,3.12],
"number_observations_unique": 11405,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.105
},
{
"type": "Completeness",
"value": 98.80
},
{
"type": "Redundancy",
"value": 5.00
}
]
},
{
"resolution_limits": [3.93,3.44],
"number_observations_unique": 11447,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.079
},
{
"type": "Completeness",
"value": 99.10
},
{
"type": "Redundancy",
"value": 4.90
}
]
},
{
"resolution_limits": [4.95,3.93],
"number_observations_unique": 11476,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "Completeness",
"value": 99.30
},
{
"type": "Redundancy",
"value": 4.80
}
]
},
{
"resolution_limits": [50.00,4.95],
"number_observations_unique": 11498,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.064
},
{
"type": "Completeness",
"value": 99.60
},
{
"type": "Redundancy",
"value": 5.10
}
]
}
]
}