Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e793e90edfed978698279a709e59a596",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 50.313,
"b": 72.176,
"c": 107.489,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.54000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [59.870,2.800],
"number_observations_unique": 9652,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.098
},
{
"type": "I/SigI",
"value": 8.501
},
{
"type": "Completeness",
"value": 82.400
}
]
},
"refln_shells": [
{
"resolution_limits": [2.90,2.80],
"number_observations_unique": 753,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.287
},
{
"type": "Completeness",
"value": 75.50
}
]
},
{
"resolution_limits": [3.02,2.90],
"number_observations_unique": 765,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.254
},
{
"type": "Completeness",
"value": 76.60
}
]
},
{
"resolution_limits": [3.15,3.02],
"number_observations_unique": 791,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.210
},
{
"type": "Completeness",
"value": 78.90
}
]
},
{
"resolution_limits": [3.32,3.15],
"number_observations_unique": 799,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.170
},
{
"type": "Completeness",
"value": 81.80
}
]
},
{
"resolution_limits": [3.53,3.32],
"number_observations_unique": 840,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.142
},
{
"type": "Completeness",
"value": 84.10
}
]
},
{
"resolution_limits": [3.80,3.53],
"number_observations_unique": 874,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.100
},
{
"type": "Completeness",
"value": 86.00
}
]
},
{
"resolution_limits": [4.18,3.80],
"number_observations_unique": 880,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "Completeness",
"value": 87.00
}
]
},
{
"resolution_limits": [4.79,4.18],
"number_observations_unique": 882,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.079
},
{
"type": "Completeness",
"value": 87.10
}
]
},
{
"resolution_limits": [6.03,4.79],
"number_observations_unique": 889,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "Completeness",
"value": 85.40
}
]
},
{
"resolution_limits": [55.00,6.03],
"number_observations_unique": 907,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "Completeness",
"value": 81.10
}
]
}
]
}