Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "29020c454b6888898931ebb9065e6328",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 91.978,
"b": 91.978,
"c": 143.942,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.54000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.750,1.800],
"number_observations_unique": 65807,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "I/SigI",
"value": 14.600
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 5.320
}
]
},
"refln_shells": [
{
"resolution_limits": [1.86,1.80],
"number_observations": 37076,
"number_observations_unique": 6477,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.346
},
{
"type": "I/SigI",
"value": 4.5
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 5.12
}
]
},
{
"resolution_limits": [1.94,1.86],
"number_observations": 37568,
"number_observations_unique": 6493,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.323
},
{
"type": "I/SigI",
"value": 4.9
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 5.04
}
]
},
{
"resolution_limits": [2.03,1.94],
"number_observations": 38007,
"number_observations_unique": 6521,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.288
},
{
"type": "I/SigI",
"value": 5.3
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 5.25
}
]
},
{
"resolution_limits": [2.13,2.03],
"number_observations": 38313,
"number_observations_unique": 6540,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.239
},
{
"type": "I/SigI",
"value": 6.1
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 5.28
}
]
},
{
"resolution_limits": [2.27,2.13],
"number_observations": 38378,
"number_observations_unique": 6529,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.188
},
{
"type": "I/SigI",
"value": 7.4
},
{
"type": "Completeness",
"value": 99.90
},
{
"type": "Redundancy",
"value": 5.30
}
]
},
{
"resolution_limits": [2.44,2.27],
"number_observations": 38853,
"number_observations_unique": 6552,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.139
},
{
"type": "I/SigI",
"value": 9.3
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 5.33
}
]
},
{
"resolution_limits": [2.69,2.44],
"number_observations": 39112,
"number_observations_unique": 6560,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.104
},
{
"type": "I/SigI",
"value": 11.8
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 5.41
}
]
},
{
"resolution_limits": [3.08,2.69],
"number_observations": 39800,
"number_observations_unique": 6619,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "I/SigI",
"value": 18.3
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 5.46
}
]
},
{
"resolution_limits": [3.88,3.08],
"number_observations": 40263,
"number_observations_unique": 6662,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "I/SigI",
"value": 28.9
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 5.61
}
]
},
{
"resolution_limits": [38.75,3.88],
"number_observations": 40554,
"number_observations_unique": 6854,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 45.4
},
{
"type": "Completeness",
"value": 99.50
},
{
"type": "Redundancy",
"value": 5.38
}
]
}
]
}