Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "dcfea34741fbe7aa45e1c19b56a036a9",
"space_group_name": "P 61",
"unit_cell": {
"a": 98.82,
"b": 98.82,
"c": 81.11,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30.0,2.35],
"number_observations_unique": 18824,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.102
},
{
"type": "I/SigI",
"value": 17.27
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 5.1
}
]
},
"refln_shells": [
{
"resolution_limits": [2.41,2.35],
"number_observations_unique": 1408,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.754
},
{
"type": "I/SigI",
"value": 2.80
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 5.08
}
]
},
{
"resolution_limits": [2.48,2.41],
"number_observations_unique": 1334,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.705
},
{
"type": "I/SigI",
"value": 3.05
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 5.10
}
]
},
{
"resolution_limits": [2.55,2.48],
"number_observations_unique": 1313,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.584
},
{
"type": "I/SigI",
"value": 3.62
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 5.11
}
]
},
{
"resolution_limits": [2.63,2.55],
"number_observations_unique": 1283,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.518
},
{
"type": "I/SigI",
"value": 4.08
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 5.13
}
]
},
{
"resolution_limits": [2.71,2.63],
"number_observations_unique": 1232,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.424
},
{
"type": "I/SigI",
"value": 5.04
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 5.12
}
]
}
]
}