Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b7401d8d0b77b001ec6d45b8652c07ce",
"space_group_name": "P 65 2 2",
"unit_cell": {
"a": 144.889,
"b": 144.889,
"c": 103.694,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97930,0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40,2.8],
"number_observations_unique": 16292,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.071
},
{
"type": "I/SigI",
"value": 14.5
},
{
"type": "Completeness",
"value": 99.88
},
{
"type": "Redundancy",
"value": 13.6
}
]
},
"refln_shells": [
{
"resolution_limits": [3.02,2.80],
"number_observations_unique": 3015,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.33
},
{
"type": "I/SigI",
"value": 6.4
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 9
}
]
},
{
"resolution_limits": [3.32,3.02],
"number_observations_unique": 3160,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.15
},
{
"type": "I/SigI",
"value": 19
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
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}
]
},
{
"resolution_limits": [3.80,3.32],
"number_observations_unique": 3258,
"quality_factors": [
{
"type": "R(merge)",
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},
{
"type": "I/SigI",
"value": 38
},
{
"type": "Completeness",
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},
{
"type": "Redundancy",
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}
]
},
{
"resolution_limits": [4.79,3.80],
"number_observations_unique": 3313,
"quality_factors": [
{
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},
{
"type": "I/SigI",
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},
{
"type": "Completeness",
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},
{
"type": "Redundancy",
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}
]
},
{
"resolution_limits": [50,4.79],
"number_observations_unique": 3490,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.04
},
{
"type": "I/SigI",
"value": 122
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 15
}
]
}
]
}