Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3b1be4f8f104b0c335c010ea634bd34b",
"space_group_name": "P 64",
"unit_cell": {
"a": 113.51,
"b": 113.51,
"c": 55.94,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.00000,0.97922,0.97939,0.91162],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [28.273,2.30],
"number_observations_unique": 18260,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "I/SigI",
"value": 11.610
},
{
"type": "Completeness",
"value": 97.300
},
{
"type": "Redundancy",
"value": 3.66
}
]
},
"refln_shells": [
{
"resolution_limits": [2.38,2.30],
"number_observations": 6212,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.41
},
{
"type": "I/SigI",
"value": 1.76
},
{
"type": "Completeness",
"value": 92.9
}
]
},
{
"resolution_limits": [2.48,2.38],
"number_observations": 7165,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.337
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "Completeness",
"value": 98.5
}
]
},
{
"resolution_limits": [2.59,2.48],
"number_observations": 6684,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.266
},
{
"type": "I/SigI",
"value": 2.8
},
{
"type": "Completeness",
"value": 98.2
}
]
},
{
"resolution_limits": [2.73,2.59],
"number_observations": 6742,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.232
},
{
"type": "I/SigI",
"value": 3.6
},
{
"type": "Completeness",
"value": 97.4
}
]
},
{
"resolution_limits": [2.90,2.73],
"number_observations": 6781,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.139
},
{
"type": "I/SigI",
"value": 5.7
},
{
"type": "Completeness",
"value": 98.2
}
]
},
{
"resolution_limits": [3.12,2.90],
"number_observations": 6730,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.095
},
{
"type": "I/SigI",
"value": 8.4
},
{
"type": "Completeness",
"value": 98.1
}
]
},
{
"resolution_limits": [3.43,3.12],
"number_observations": 6623,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "I/SigI",
"value": 13.4
},
{
"type": "Completeness",
"value": 97.5
}
]
},
{
"resolution_limits": [3.93,3.43],
"number_observations": 6471,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "I/SigI",
"value": 20.4
},
{
"type": "Completeness",
"value": 96.4
}
]
},
{
"resolution_limits": [4.93,3.93],
"number_observations": 6566,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.03
},
{
"type": "I/SigI",
"value": 27.4
},
{
"type": "Completeness",
"value": 98.2
}
]
},
{
"resolution_limits": [28.3,4.93],
"number_observations": 6889,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 30.1
},
{
"type": "Completeness",
"value": 97.4
}
]
}
]
}