Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2e6093c01f3044f7667a374701fa3c27",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 54.322,
"b": 79.181,
"c": 54.857,
"alpha": 90.00,
"beta": 105.53,
"gamma": 90.00
},
"wavelengths": [1.54178],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [28.0,1.8],
"number_observations_unique": 209537,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.047
},
{
"type": "Completeness",
"value": 98.9
},
{
"type": "Redundancy",
"value": 5.2
}
]
},
"refln_shells": [
{
"resolution_limits": [1.86,1.8],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.229
},
{
"type": "I/SigI",
"value": 3.0
},
{
"type": "Completeness",
"value": 90.8
},
{
"type": "Redundancy",
"value": 1.7
}
]
},
{
"resolution_limits": [1.94,1.86],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.188
},
{
"type": "I/SigI",
"value": 5.0
},
{
"type": "Completeness",
"value": 98.3
},
{
"type": "Redundancy",
"value": 2.7
}
]
},
{
"resolution_limits": [2.03,1.94],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.144
},
{
"type": "I/SigI",
"value": 7.9
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 3.3
}
]
},
{
"resolution_limits": [2.13,2.03],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.125
},
{
"type": "I/SigI",
"value": 10
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 4
}
]
},
{
"resolution_limits": [2.27,2.13],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.113
},
{
"type": "I/SigI",
"value": 14
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 4.8
}
]
},
{
"resolution_limits": [2.44,2.27],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.095
},
{
"type": "I/SigI",
"value": 18.3
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 5.5
}
]
}
]
}